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754159-68-7
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Basic Information
CAS No.: 754159-68-7
Name: 3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid
Molecular Structure:
Molecular Structure of 754159-68-7 (3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid)
Formula: C29H35NO3
Molecular Weight: 445.602
Synonyms: 3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid;
Density: 1.095
PSA: 49.77000
LogP: 6.60460
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Synthetic route
140-10-3

(E)-3-phenylacrylic acid

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 8 steps
1.1: sulfuric acid / 120 - 125 °C
2.1: potassium carbonate; sodium iodide / acetone / Reflux
3.1: sodium tetrahydroborate / 1,2-dimethoxyethane / 0.17 h
3.2: 3 h / 10 °C
4.1: triethylamine / dichloromethane / 12 h / 25 - 30 °C
5.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
6.1: isopropyl alcohol / 15 h / 25 - 86 °C
7.1: sodium hydroxide / water
8.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
8.2: 1 h / -65 - -60 °C
View Scheme
950773-38-3

R-(-)-[3-(2-benzyloxy-5-bromophenyl)-3-phenylpropyl]diisopropylamine

124-38-9

carbon dioxide

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Stage #1: R-(-)-[3-(2-benzyloxy-5-bromophenyl)-3-phenylpropyl]diisopropylamine With ethyl bromide; iodine; magnesium In tetrahydrofuran at 55℃; for 1h; Reflux;
Stage #2: carbon dioxide In tetrahydrofuran at -65 - -60℃; for 1h;
Stage #1: R-(-)-[3-(2-benzyloxy-5-bromophenyl)-3-phenylpropyl]diisopropylamine With ethyl bromide; iodine; magnesium In tetrahydrofuran at 60 - 65℃; for 2h; Inert atmosphere;
Stage #2: carbon dioxide In tetrahydrofuran at -70 - -50℃; for 1h;

(+/-)-3-(2-benzyloxy-5-bromophenyl)-3-phenylpropane-1-ol

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 5 steps
1.1: triethylamine / dichloromethane / 12 h / 25 - 30 °C
2.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
3.1: isopropyl alcohol / 15 h / 25 - 86 °C
4.1: sodium hydroxide / water
5.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
5.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 6 steps
1.1: dmap; triethylamine / dichloromethane / 20 °C
2.1: potassium iodide / acetonitrile / 15 h / Reflux
3.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / Reflux
3.2: 1 h / -60 - -25 °C
3.3: 1 h / 0 - 20 °C
4.1: ammonia / ethyl acetate; water / pH 8 - 9
5.1: methanol / 50 - 65 °C
6.1: ammonia / water / pH 8 - 9
View Scheme
Multi-step reaction with 4 steps
1.1: dmap; triethylamine / dichloromethane / 2 h / 0 - 5 °C
2.1: acetonitrile / 32 h / 95 - 100 °C / autoclave; Inert atmosphere
3.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
3.2: 1.5 h / -70 - -60 °C / Inert atmosphere
3.3: -10 - 25 °C
4.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
4.2: 10 - 15 °C
View Scheme

(+/-)-N,N-diisopropyl-3-(2-benzyloxy-5-bromophenyl)-3-phenylpropylamine

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1.1: isopropyl alcohol / 15 h / 25 - 86 °C
2.1: sodium hydroxide / water
3.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
3.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 4 steps
1.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / Reflux
1.2: 1 h / -60 - -25 °C
1.3: 1 h / 0 - 20 °C
2.1: ammonia / ethyl acetate; water / pH 8 - 9
3.1: methanol / 50 - 65 °C
4.1: ammonia / water / pH 8 - 9
View Scheme
Multi-step reaction with 2 steps
1.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
1.2: 1.5 h / -70 - -60 °C / Inert atmosphere
1.3: -10 - 25 °C
2.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
2.2: 10 - 15 °C
View Scheme
106-41-2

4-bromo-phenol

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 8 steps
1.1: sulfuric acid / 120 - 125 °C
2.1: potassium carbonate; sodium iodide / acetone / Reflux
3.1: sodium tetrahydroborate / 1,2-dimethoxyethane / 0.17 h
3.2: 3 h / 10 °C
4.1: triethylamine / dichloromethane / 12 h / 25 - 30 °C
5.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
6.1: isopropyl alcohol / 15 h / 25 - 86 °C
7.1: sodium hydroxide / water
8.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
8.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 7 steps
1.1: sulfuric acid / 12 h / 120 - 125 °C
2.1: potassium carbonate; sodium iodide / acetone / 25 - 30 °C
2.2: 5.5 h / 15 °C / Reflux
3.1: sodium bis(2-methoxyethoxy)aluminium dihydride / toluene / 4 h / 5 - 10 °C / Inert atmosphere
4.1: dmap; triethylamine / dichloromethane / 2 h / 0 - 5 °C
5.1: acetonitrile / 32 h / 95 - 100 °C / autoclave; Inert atmosphere
6.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
6.2: 1.5 h / -70 - -60 °C / Inert atmosphere
6.3: -10 - 25 °C
7.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
7.2: 10 - 15 °C
View Scheme
156755-23-6

6-bromo-4-phenyl-3,4-dihydro-2H-chromen-2-one

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 7 steps
1.1: potassium carbonate; sodium iodide / acetone / Reflux
2.1: sodium tetrahydroborate / 1,2-dimethoxyethane / 0.17 h
2.2: 3 h / 10 °C
3.1: triethylamine / dichloromethane / 12 h / 25 - 30 °C
4.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
5.1: isopropyl alcohol / 15 h / 25 - 86 °C
6.1: sodium hydroxide / water
7.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
7.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 6 steps
1.1: potassium carbonate; sodium iodide / acetone / 25 - 30 °C
1.2: 5.5 h / 15 °C / Reflux
2.1: sodium bis(2-methoxyethoxy)aluminium dihydride / toluene / 4 h / 5 - 10 °C / Inert atmosphere
3.1: dmap; triethylamine / dichloromethane / 2 h / 0 - 5 °C
4.1: acetonitrile / 32 h / 95 - 100 °C / autoclave; Inert atmosphere
5.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
5.2: 1.5 h / -70 - -60 °C / Inert atmosphere
5.3: -10 - 25 °C
6.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
6.2: 10 - 15 °C
View Scheme
Multi-step reaction with 8 steps
1.1: potassium carbonate / 60 - 65 °C
2.1: sodium hydroxide / water / 45 - 50 °C
3.1: ethanol / 5.83 h / 0 - 75 °C
4.1: hydrogenchloride / water; toluene / 1 h / 20 - 25 °C
5.1: thionyl chloride; N,N-dimethyl-formamide / toluene / 50 - 55 °C
6.1: toluene / 1 h / 0 - 35 °C
7.1: tetrahydrofuran / 4.5 h / 60 - 65 °C
8.1: iodine; magnesium; ethyl bromide / tetrahydrofuran / 2 h / 60 - 65 °C / Inert atmosphere
8.2: 1 h / -70 - -50 °C
View Scheme
Multi-step reaction with 8 steps
1.1: potassium carbonate / 60 - 65 °C
2.1: sodium hydroxide / water / 45 - 50 °C
3.1: ethanol / 5.83 h / 0 - 75 °C
4.1: hydrogenchloride / water; toluene / 1 h / 20 - 25 °C
5.1: thionyl chloride; N,N-dimethyl-formamide / toluene / 50 - 55 °C
6.1: toluene / 1 h / 0 - 35 °C
7.1: iodine; lithium aluminium tetrahydride / tetrahydrofuran / 2.25 h / 0 - 65 °C
8.1: iodine; magnesium; ethyl bromide / tetrahydrofuran / 2 h / 60 - 65 °C / Inert atmosphere
8.2: 1 h / -70 - -50 °C
View Scheme
156755-24-7

methyl 3-[2-(benzyloxy)-5-bromophenyl]-3-phenylpropanoate

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 6 steps
1.1: sodium tetrahydroborate / 1,2-dimethoxyethane / 0.17 h
1.2: 3 h / 10 °C
2.1: triethylamine / dichloromethane / 12 h / 25 - 30 °C
3.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
4.1: isopropyl alcohol / 15 h / 25 - 86 °C
5.1: sodium hydroxide / water
6.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
6.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 5 steps
1.1: sodium bis(2-methoxyethoxy)aluminium dihydride / toluene / 4 h / 5 - 10 °C / Inert atmosphere
2.1: dmap; triethylamine / dichloromethane / 2 h / 0 - 5 °C
3.1: acetonitrile / 32 h / 95 - 100 °C / autoclave; Inert atmosphere
4.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
4.2: 1.5 h / -70 - -60 °C / Inert atmosphere
4.3: -10 - 25 °C
5.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
5.2: 10 - 15 °C
View Scheme
Multi-step reaction with 7 steps
1.1: sodium hydroxide / water / 45 - 50 °C
2.1: ethanol / 5.83 h / 0 - 75 °C
3.1: hydrogenchloride / water; toluene / 1 h / 20 - 25 °C
4.1: thionyl chloride; N,N-dimethyl-formamide / toluene / 50 - 55 °C
5.1: toluene / 1 h / 0 - 35 °C
6.1: tetrahydrofuran / 4.5 h / 60 - 65 °C
7.1: iodine; magnesium; ethyl bromide / tetrahydrofuran / 2 h / 60 - 65 °C / Inert atmosphere
7.2: 1 h / -70 - -50 °C
View Scheme
Multi-step reaction with 7 steps
1.1: sodium hydroxide / water / 45 - 50 °C
2.1: ethanol / 5.83 h / 0 - 75 °C
3.1: hydrogenchloride / water; toluene / 1 h / 20 - 25 °C
4.1: thionyl chloride; N,N-dimethyl-formamide / toluene / 50 - 55 °C
5.1: toluene / 1 h / 0 - 35 °C
6.1: iodine; lithium aluminium tetrahydride / tetrahydrofuran / 2.25 h / 0 - 65 °C
7.1: iodine; magnesium; ethyl bromide / tetrahydrofuran / 2 h / 60 - 65 °C / Inert atmosphere
7.2: 1 h / -70 - -50 °C
View Scheme
250214-37-0

(+/-)-toluene-4-sulphonic acid 3-(2-benzyloxy-5-bromophenyl)-3-phenylpropyl ester

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1.1: acetonitrile / 30 h / 95 - 100 °C / autoclave; Sealed tube
2.1: isopropyl alcohol / 15 h / 25 - 86 °C
3.1: sodium hydroxide / water
4.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
4.2: 1 h / -65 - -60 °C
View Scheme
Multi-step reaction with 5 steps
1.1: potassium iodide / acetonitrile / 15 h / Reflux
2.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / Reflux
2.2: 1 h / -60 - -25 °C
2.3: 1 h / 0 - 20 °C
3.1: ammonia / ethyl acetate; water / pH 8 - 9
4.1: methanol / 50 - 65 °C
5.1: ammonia / water / pH 8 - 9
View Scheme
Multi-step reaction with 3 steps
1.1: acetonitrile / 32 h / 95 - 100 °C / autoclave; Inert atmosphere
2.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 4 h / 50 - 55 °C / Inert atmosphere
2.2: 1.5 h / -70 - -60 °C / Inert atmosphere
2.3: -10 - 25 °C
3.1: D-tartaric acid / isopropyl alcohol / 16 h / 30 - 35 °C
3.2: 10 - 15 °C
View Scheme
1135493-18-3

C20H18O8*C28H34BrNO

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: sodium hydroxide / water
2.1: ethyl bromide; iodine; magnesium / tetrahydrofuran / 1 h / 55 °C / Reflux
2.2: 1 h / -65 - -60 °C
View Scheme

(-)-N,N-Diisopropyl-3-(2-benzyloxy-5-carboxyphenyl)-3-phenylpropylamine hydrochloride

754159-68-7

4-(benzyloxy)-3-[(1R)-3-(dipropan-2-ylamino)-1-phenylpropyl]benzoic acid

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: ammonia / ethyl acetate; water / pH 8 - 9
2: methanol / 50 - 65 °C
3: ammonia / water / pH 8 - 9
View Scheme
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    Reliable Pharmatech is a customer-oriented company. We focus on providing quality pharmaceutical raw materials and intermediates. Drawing on over ten years experience, we

  • Reliable Pharmatech (Tianjin) Co., Ltd.

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:86-22-28567687

    Address:Zuoanmingdi, Xianshuigu, Jinnan District

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  • 3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid

  • Casno:

    754159-68-7

    3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid

    Min.Order: 1 Milligram

    FOB Price:  USD $ 10.0-10.0

    Q1:Are you manufacturer or trading company? A1: Manufacturer. Q2: Can I get some sample? A2: Yes Q3: What's your MOQ? A3: Our MOQ is flexible.different price for different quantity Q4: Is there a discount? A4: Of course, welcome to contact us.

    WEIFANG YANGXU GROUP Co., Ltd was founded in 1996. More than 20 years full efforts, YANGXU chemical has grown to be a large enzyme peptide chemical enterprise, specializing in expl

  • weifang yangxu group co.,ltd

     China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+08613666361637--

    Address:No 5.dongfeng east street.gaoxin district.weifang city.

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  • Benzoicacid, 3-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)-

  • Casno:

    754159-68-7

    Benzoicacid, 3-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)-

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    United Scientific Company Located in Shanghai of China , is a competitive player in the global specialty and fine chemical market. Fenghua has both the expertise and flexibility to produce a wide range of chemicals. Focusing on developing the innovat

    United Scientific Company (USC) Located in Shanghai of China , is a competitive player in the global specialty and fine chemical market. USC has both the expertise and flexibility

  • Shanghai united Scientific Co.,Ltd.

    China (Mainland)  |  Contact Details

    Business Type:Lab/Research institutions

    Tel:+86-21-53535353

    Address:28F No.900 huaihai Road Shanghai China

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  • (R)-4-Benzyloxy-3-(3-diisopropylamino-1-phenylpropyl)benzoic acid

  • Casno:

    754159-68-7

    (R)-4-Benzyloxy-3-(3-diisopropylamino-1-phenylpropyl)benzoic acid

    Min.Order: 0

    FOB Price:  USD $ 0.0-0.0

    With about ten years experiences in the field of pharmaceutical chemicals, Yierdechem has established solid business cooperation relationships with many large companys worldwide.As a leading supplier of API and pharmaceutical intermediates, holds its

    yierdechem is a young and potential team, with about ten years experiences in the field of pharmaceutical intermediate and fine chemicals, yierdechem has established solid business

  • Hangzhou Yierdechem Co. Ltd

    China (Mainland)  |  Contact Details

    Business Type:Other

    Tel:+86-571-86904883

    Address:903,zhijiang Minglou, Xiasha EDA, Hangzhou City 310018,P.R.China

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Chemistry

Product Name: Benzoicacid, 3-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)- (CAS NO.754159-68-7)

Molecular Formula: C29H35NO3
Molecular Weight: 445.59g/mol
Mol File: 754159-68-7.mol
Density: 1.095

Specification

 Benzoicacid, 3-[(1R)-3-[bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)- , its CAS NO. is 754159-68-7, the synonym is 3-[(1R)-3-[Bis(1-methylethyl)amino]-1-phenylpropyl]-4-(phenylmethoxy)benzoic acid .