Products Categories
| CAS No.: | 97664-55-6 |
|---|---|
| Name: | 6-N-Benzylamino-1-(4'-phenylbutoxy)Hexane |
| Molecular Structure: | |
|
|
|
| Formula: | C23H33NO |
| Molecular Weight: | 339.521 |
| Synonyms: | N-Benzyl-6-(4-phenylbutoxy)hexan-1-amine;[6-(4-Phenylbutoxy)hexyl]benzylamine;6-Benzylamino-1-(4'-phenylbutoxy)hexane; |
| EINECS: | 692-628-2 |
| Density: | 0.979 g/cm3 |
| Boiling Point: | 467.238 °C at 760 mmHg |
| Flash Point: | 207.26 °C |
| PSA: | 21.26000 |
| LogP: | 5.76700 |
- 99170-93-1N-Methyl-2-oxazolamine
- 97730-31-9(S)-4'-(2-Methylbutyl)Biphenyl-4-Carbonitrile
- 98020-47-46-Amino-5-nitro-2-thio-uracil
- 98025-62-8(5-METHYL-[1,3,4]THIADIAZOL-2-YL)-HYDRAZINE
- 99724-17-1Dimethyl-pyrrolidin-3-ylmethyl-amine
- 98084-25-4CESIUM TITANATE 99.9+%
- 98296-48-1GANODERIC ACID C2(SH)
- 99421-19-9ethyl 3-amino-6-chloro-5-cyano-2-methylisonicotinate
- 99689-20-02-Acetamido-3-O-(D-1-carboxyethyl)-2-deoxy-2-D-glucose Methyl Ester
- 98730-77-91-(hydroxymethyl)cyclopropanecarbonitrile
- 94749-73-2
6-bromohexyl 4-phenylbutyl ether
- 100-46-9
benzylamine
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Stage #1: benzylamine With triethylamine; potassium iodide In acetonitrile at 45℃; Stage #2: 6-bromohexyl 4-phenylbutyl ether In acetonitrile | 76% |
| With triethylamine; sodium iodide | 75% |
| With triethylamine; sodium iodide In dimethyl sulfoxide for 17h; Ambient temperature; | 70% |
| With caesium carbonate In N,N-dimethyl-formamide at 60 - 80℃; for 5h; | 38% |
| Conditions | Yield |
|---|---|
| With sodium tetrahydroborate; molecular sieve 2.) ethanol; Yield given. Multistep reaction; |
- 629-03-8
1 ,6-dibromohexane
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: 51 percent / NaOH; tetra-n-butylammonium hydrogen sulphate; benzyltrimethylammonium chloride / CH2Cl2; H2O / 192 h / 20 °C 2: 38 percent / Cs2CO3 / dimethylformamide / 5 h / 60 - 80 °C View Scheme | |
| Multi-step reaction with 4 steps 1: 60 percent 2: NaN3 / dimethylformamide 3: lithium aluminum hydride 4: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol View Scheme | |
| Multi-step reaction with 2 steps 1: potassium hydroxide; tetrabutylammomium bromide / toluene / 10 h / 20 °C 2: triethylamine; potassium iodide / acetonitrile / 45 °C View Scheme |
- 3360-41-6
4-phenyl-butan-1-ol
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: 51 percent / NaOH; tetra-n-butylammonium hydrogen sulphate; benzyltrimethylammonium chloride / CH2Cl2; H2O / 192 h / 20 °C 2: 38 percent / Cs2CO3 / dimethylformamide / 5 h / 60 - 80 °C View Scheme | |
| Multi-step reaction with 2 steps 1: 81 percent / NaH / tetrahydrofuran / 7 h / Ambient temperature 2: 70 percent / Et3N, NaI / dimethylsulfoxide / 17 h / Ambient temperature View Scheme | |
| Multi-step reaction with 4 steps 1: 60 percent 2: NaN3 / dimethylformamide 3: lithium aluminum hydride 4: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol View Scheme | |
| Multi-step reaction with 2 steps 1: potassium hydroxide; tetrabutylammomium bromide / toluene / 10 h / 20 °C 2: triethylamine; potassium iodide / acetonitrile / 45 °C View Scheme | |
| Multi-step reaction with 3 steps 1.1: sodium hydroxide / 2 h / 60 °C 1.2: 4 h / 110 °C 2.1: triethylamine / toluene / 5 h / 5 - 10 °C 3.1: sodium hydroxide / toluene / 12 h / 110 °C View Scheme |
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: 81 percent / NaH / tetrahydrofuran / 7 h / Ambient temperature 2: 70 percent / Et3N, NaI / dimethylsulfoxide / 17 h / Ambient temperature View Scheme |
- 94749-73-2
6-bromohexyl 4-phenylbutyl ether
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1: NaN3 / dimethylformamide 2: lithium aluminum hydride 3: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol View Scheme |
- 168412-89-3
1-azido-6-(4-phenylbutoxy)hexane
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 2 steps 1: lithium aluminum hydride 2: 1.) mol. sieves; 2.) NaBH4 / 2.) ethanol View Scheme |
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| With sodium carbonate In dichloromethane; water at 25 - 30℃; for 0.5h; pH=~ 8; |
- 135235-81-3
6-(4-phenylbutyloxy)hexyl methanesulfonate
- 100-46-9
benzylamine
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| With sodium hydroxide In toluene at 110℃; for 12h; |
- 629-11-8
1,6-hexanediol
- 97664-55-6
N-[6-(4-phenylbutoxy)hexyl]benzenemethanamine
| Conditions | Yield |
|---|---|
| Multi-step reaction with 3 steps 1.1: sodium hydroxide / 2 h / 60 °C 1.2: 4 h / 110 °C 2.1: triethylamine / toluene / 5 h / 5 - 10 °C 3.1: sodium hydroxide / toluene / 12 h / 110 °C View Scheme |
What can I do for you?
Get Best Price
Specification
The 6-Benzylamino-1-(4'-phenylbutoxy)hexane, with the CAS registry number 97664-55-6, is also known as [6-(4-Phenylbutoxy)hexyl]benzylamine. This chemical's molecular formula is C23H33NO and molecular weight is 339.51. What's more, its systematic name is N-Benzyl-6-(4-phenylbutoxy)-1-hexanamine.
Physical properties of 6-Benzylamino-1-(4'-phenylbutoxy)hexane are: (1)ACD/LogP: 5.729; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 11.31; (6)ACD/BCF (pH 7.4): 68.46; (7)ACD/KOC (pH 5.5): 26.48; (8)ACD/KOC (pH 7.4): 160.29; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 14; (12)Polar Surface Area: 21.26 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 107.325 cm3; (15)Molar Volume: 346.692 cm3; (16)Polarizability: 42.547×10-24cm3; (17)Surface Tension: 38.2 dyne/cm; (18)Density: 0.979 g/cm3; (19)Flash Point: 207.26 °C; (20)Enthalpy of Vaporization: 72.918 kJ/mol; (21)Boiling Point: 467.238 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O(CCCCc1ccccc1)CCCCCCNCc2ccccc2
(2)Std. InChI: InChI=1S/C23H33NO/c1(10-18-24-21-23-16-7-4-8-17-23)2-11-19-25-20-12-9-15-22-13-5-3-6-14-22/h3-8,13-14,16-17,24H,1-2,9-12,15,18-21H2
(3)Std. InChIKey: JWLIKZBRVQRFNF-UHFFFAOYSA-N