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39133-31-8

Basic Information
CAS No.: 39133-31-8
Name: 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester
Article Data: 3
Molecular Structure:
Molecular Structure of 39133-31-8 (3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester)
Formula: C22H29NO5
Molecular Weight: 387.476
Synonyms: 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester;2-Dimethylamino-2-phenylbutyl 3,4,5-trimethoxybenzoat;beta-(Dimethylamino)-beta-ethylphenethyl alcohol 3,4,5-trimethoxybenzoate (ester);
EINECS: 254-309-2
Density: 1.104 g/cm3
Melting Point: 79oC
Boiling Point: 457.9 °C at 760 mmHg
Flash Point: 230.8 °C
Solubility: 10g/L
PSA: 57.23000
LogP: 3.73630
Raw Materials
557-04-0
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    Address:Building 87,Lane 669, Dong Jing Road Shanghai,P.R.China

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  • Benzoic acid,3,4,5-trimethoxy-, 2-(dimethylamino)-2-phenylbutyl ester

  • Casno:

    39133-31-8

    Benzoic acid,3,4,5-trimethoxy-, 2-(dimethylamino)-2-phenylbutyl ester

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 0.0-0.0

    Superior quality, moderate price & quick delivery. Appearance:white crystalline powder Storage:Stored in cool, dry and ventilation place; Away from fire and heat Package:1kg/bag, 1kg/drum or 25kg/drum or as per your request. Application:Trimebu

    Hangzhou Yunuo Chemical Co., Ltd. is located in Hangzhou City, China We are specialized in fine chemicals and basic chemical auxiliary materials, Organic compounds, rubber

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  • 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester

  • Casno:

    39133-31-8

    3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester

    Min.Order: 10 Gram

    FOB Price:  USD $ 0.0-0.0

    Established in May 2015, TaiChem Ltd. is initially invested by a British research and development company and started by PhDs back from aboard. The company is registered in China Medical City (CMC), Taizhou, Jiangsu Province, and the production site

    TaiChem was established in 2015 and registered in China medical city - Taizhou, Jiangsu Province. The company has about 1800 square meters of class A plant facility. TaiChem focuse

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    Address:Changjiang Dadao 18

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  • Lower Price Trimebutine on stock

  • Casno:

    39133-31-8

    Lower Price Trimebutine on stock

    Min.Order: 1 Kilogram

    FOB Price:  USD $ 0.0-0.0

    Product name: Trimebutine CAS No.: 39133-31-8 Molecule Formula:C22H29NO5 Molecule Weight:387.47 Purity: 99.0% Package: 25kg/drum Description:White powder Manufacture Standards:Enterprise Standard TESTING ITEMS SPE

    Siwei Development Group Ltd. is a reputed professional enterprise in China dedicated to the Amino Acids production and sales of fine chemical products.Over the years we have been m

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    Tel:86-571-82881840

    Address:Rm2-2-503 Zhongdingyuan, Xianghurenjia Wenyan Xiaoshan, Hangzhou China

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  • trimebutinefreebase

  • Casno:

    39133-31-8

    trimebutinefreebase

    Min.Order: 1 Milligram

    FOB Price:  USD $ 0.0-0.0

    GMP standard, high purity, competitive price, in stock 1. Quick Response: within 6 hours after receiving your email. 2. Quality Guarantee: All products are strictly tested by our QC, confirmed by QA, and approved by a third-party lab in China, USA,

  •  Xiamen Jenny Chemical Technology Co., Ltd.

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    Address:xiameng

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  • 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester

  • Casno:

    39133-31-8

    3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester

    Min.Order: 1 Gram

    FOB Price:  USD $ 0.0-0.0

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, special chemicals and OLED intermediates and other fine chemicals. W

    Shandong Mopai Biotechnology Co., LTD is a leading manufacturer and supplier of chemicals in China. We develop produce and distribute high quality pharmaceuticals, intermediates, s

  •  Shandong Mopai Biotechnology Co., LTD

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    Tel:+86-15965530500

    Address:shandong

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Specification

The CAS register number of Trimebutine is 39133-31-8. It also can be called as 3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester and the IUPAC name about this chemical is [2-(dimethylamino)-2-phenylbutyl] 3,4,5-trimethoxybenzoate. The molecular formula about this chemical is C22H29NO5 and the molecular weight is 387.47. It belongs to the Active Pharmaceutical Ingredients. This chemical is a drug with antimuscarinic and weak mu opioid agonist effects and it can be proposed spasmolytic with possible local anesthetic action used in gastrointestinal disorders.

Physical properties about Trimebutine are: (1)ACD/LogP: 4.34; (2)ACD/LogD (pH 5.5): 2.56; (3)ACD/LogD (pH 7.4): 4.09; (4)ACD/BCF (pH 5.5): 19.38; (5)ACD/BCF (pH 7.4): 653.98; (6)ACD/KOC (pH 5.5): 90.68; (7)ACD/KOC (pH 7.4): 3060.71; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 10; (10)Polar Surface Area: 57.23Å2; (11)Index of Refraction: 1.534; (12)Molar Refractivity: 109 cm3; (13)Molar Volume: 350.6 cm3; (14)Polarizability: 43.21x10-24cm3; (15)Surface Tension: 38 dyne/cm; (16)Enthalpy of Vaporization: 71.82 kJ/mol; (17)Boiling Point: 457.9 °C at 760 mmHg; (18)Vapour Pressure: 1.43E-08 mmHg at 25°C.

The Trimebutine is an opiate modulator of the gastrointestinal motility that interacts with enkephalinergic receptors.  The actions of trimebutine [3,4,5-trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutylester] on the gastrointestinal tract are mediated via  an agonist effect on peripheral mu, kappa and delta opiate receptors and release of gastrointestinal peptides such as motilin and modulation of the release of other peptides, including vasoactive intestinal peptide, gastrin and glucagon. Trimebutine accelerates gastric emptying, induces premature phase III of the migrating motor complex in the intestine and modulates the contractile activity of the colon. Recently, trimebutine has also been shown to decrease reflexes induced by distension of the gut lumen in animals and it may therefore modulate visceral sensitivity. Clinically, trimebutine has proved to be effective in the treatment of both acute and chronic abdominal pain in patients with functional bowel disorders, especially irritable bowel syndrome, at doses ranging from 300 to 600 mg/day. This chemical is also effective in children presenting with abdominal pain.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(c1ccccc1)(N(C)C)CC)c2cc(OC)c(OC)c(OC)c2
(2)InChI: InChI=1/C22H29NO5/c1-7-22(23(2)3,17-11-9-8-10-12-17)15-28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5/h8-14H,7,15H2,1-6H3
(3)InChIKey: LORDFXWUHHSAQU-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C22H29NO5/c1-7-22(23(2)3,17-11-9-8-10-12-17)15-28-21(24)16-13-18(25-4)20(27-6)19(14-16)26-5/h8-14H,7,15H2,1-6H3
(5)Std. InChIKey: LORDFXWUHHSAQU-UHFFFAOYSA-N