Methyl (E)-3,4,5-trimethoxycinnamate supplier

Name
METHYL 3,4,5-TRIMETHOXYCINNAMATE
EINECS
CAS No. 20329-96-8
Article Data38
CAS DataBase
Density 1.134 g/cm³
Solubility
Melting Point 91-92 °C
Formula C₁₃H₁₆O₅
Boiling Point 370.6 °C at 760 mmHg
Molecular Weight 252.267
Flash Point 163.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Propenoicacid, 3-(3,4,5-trimethoxyphenyl)-, methyl ester, (E)-;Cinnamic acid,3,4,5-trimethoxy-, methyl ester, (E)- (8CI);Methyl 3,4,5-trimethoxy-trans-cinnamate;Methyltrans-3,4,5-trimethoxycinnamate;Methyltrans-3-(3,4,5-trimethoxyphenyl)acrylate;
PSA
LogP

Methyl (E)-3,4,5-trimethoxycinnamate Specification

The CAS register number of 2-Propenoic acid,3-(3,4,5-trimethoxyphenyl)-, methyl ester, (2E)- is 20329-96-8. It also can be called as (E)-methyl 3-(3,4,5-trimethoxyphenyl)acrylate and the systematic name about this chemical is methyl (2E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate. The molecular formula about this chemical is C₁₃H₁₆O₅ and the molecular weight is 252.26. It belongs to the following product categories which include Esters; Phenyls & Phenyl-Het and so on.

Physical properties about 2-Propenoic acid,3-(3,4,5-trimethoxyphenyl)-, methyl ester, (2E)- are: (1)ACD/LogP: 1.77; (2)#H bond acceptors: 5; (3)#Freely Rotating Bonds: 6; (4)Polar Surface Area: 53.99Å²; (5)Index of Refraction: 1.528; (6)Molar Refractivity: 68.58 cm³; (7)Molar Volume: 222.4 cm³; (8)Polarizability: 27.18x10^-24cm³; (9)Surface Tension: 35.9 dyne/cm; (10)Flash Point: 163.5 °C; (11)Enthalpy of Vaporization: 61.76 kJ/mol; (12)Boiling Point: 370.6 °C at 760 mmHg; (13)Vapour Pressure: 1.09E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)\C=C\c1cc(OC)c(OC)c(OC)c1
(2)InChI: InChI=1/C13H16O5/c1-15-10-7-9(5-6-12(14)17-3)8-11(16-2)13(10)18-4/h5-8H,1-4H3/b6-5+
(3)InChIKey: KLXHCGFNNUQTEY-AATRIKPKBY
(4)Std. InChI: InChI=1S/C13H16O5/c1-15-10-7-9(5-6-12(14)17-3)8-11(16-2)13(10)18-4/h5-8H,1-4H3/b6-5+
(5)Std. InChIKey: KLXHCGFNNUQTEY-AATRIKPKSA-N

Product Name

METHYL 3,4,5-TRIMETHOXYCINNAMATE

Methyl (E)-3,4,5-trimethoxycinnamate Specification

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