| Identification | More | [Name]
3,4,5-Trimethoxybenzoic acid 2-(dimethylamino)-2-phenylbutyl ester | [CAS]
39133-31-8 | [Synonyms]
2'-PHENYL-2'-DIMETHYLAMINO-N-BUTYL-3',4',5'-TRIMETHOXYBENZOATE
3,4,5-TRIMETHOXYBENZOATE,-2'-PHENYL-2'-DIMETHYLAMINO-N-BUTYL
3,4,5-TRIMETHOXYBENZOIC ACID 2-[DIMETHYLAMINO]-2-PHENYLBUTYL ESTER
TRIMEBUTIN
TRIMEBUTINE
trimebutine free base
Trimebutine hydrochloride
TRIMEBUTINE3.4.5-TRIMETHOXYBENZOATE,-2'-PHENYL-2'-DIMETHYLAMINO-N-BUTYL
TrimebutineMeleate34140-59-5/Base
3,4,5-TRIMETHOXYBENZOICACID2-(DIMETHYLAMINO)-2-PHENYLBUTYLESTER(TRIMEBUTINE)
Benzoic acid, 3,4,5-trimethoxy-, 2-(dimethylamino)-2-phenylbutyl ester (9CI) | [EINECS(EC#)]
254-309-2 | [Molecular Formula]
C22H29NO5 | [MDL Number]
MFCD00133873 | [Molecular Weight]
387.47 | [MOL File]
39133-31-8.mol |
| Chemical Properties | Back Directory | [Melting point ]
78-80°C | [Boiling point ]
513.42°C (rough estimate) | [density ]
1.1998 (rough estimate) | [refractive index ]
1.5614 (estimate) | [storage temp. ]
2-8°C
| [solubility ]
Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Very Slightly) | [form ]
neat | [pka]
7.29±0.50(Predicted) | [color ]
White to Off-White | [Water Solubility ]
10g/L | [Merck ]
14,9699 | [Major Application]
forensics and toxicology
pharmaceutical (small molecule)
veterinary | [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 | [InChIKey]
LORDFXWUHHSAQU-UHFFFAOYSA-N | [SMILES]
CCC(COC(=O)c1cc(OC)c(OC)c(OC)c1)(N(C)C)c2ccccc2 | [CAS DataBase Reference]
39133-31-8(CAS DataBase Reference) |
| Hazard Information | Back Directory | [Uses]
Trimebutine is an agonist of peripheral mu, kappa and delta opiate receptors, used as spasmolytic agent for treatment of both acute and chronic abdominal pain. | [Uses]
Trimebutine is an opioid receptor agonist and an antispasmodic agent (1,2). It is used to treat acute and chronic abdominal pain. | [Definition]
ChEBI: 3,4,5-trimethoxybenzoic acid [2-(dimethylamino)-2-phenylbutyl] ester is a trihydroxybenzoic acid. |
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