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Basic Information
CAS No.: 139-76-4
Name: N-(3,4-Dimethoxyphenethyl)-2-(3,4-dimethoxyphenyl)acetamide
Article Data: 57
Molecular Structure:
Molecular Structure of 139-76-4 (N-(3,4-Dimethoxyphenethyl)-2-(3,4-dimethoxyphenyl)acetamide)
Formula: C20H25NO5
Molecular Weight: 359.422
Synonyms: Acetamide, N- (3,4-dimethoxyphenethyl)-2-(3,4-dimethoxyphenyl)-;Benzeneacetamide, N-[2- (3,4-dimethoxyphenyl)ethyl]-3, 4-dimethoxy-;
EINECS: 205-374-0
Density: 1.13g/cm3
Boiling Point: 559.3 °C at 760 mmHg
Flash Point: 292 °C
PSA: 66.02000
LogP: 3.01330
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Chemistry

IUPAC Name: 2-(3,4-Dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Synonyms of N-(3,4-Dimethoxyphenethyl)-2-(3,4-dimethoxyphenyl)acetamide (CAS NO.139-76-4): N-[2-(3,4-dimethoxyphenyl)ethyl]-3,4-dimethoxyphenylacetam ; N-(3,4-Dimethoxyphenethyl)-3,4-dimethoxybenzeneacetamide ; N-[2-(3,4-Dimethoxyphenyl)ethyl]-3,4-dimethoxybenzeneacetamide
CAS NO: 139-76-4
Molecular Formula: C20H25NO5
Molecular Weight: 359.4162
Molecular Structure:
 
H bond acceptors: 6
H bond donors: 1
Freely Rotating Bonds: 9
Polar Surface Area: 57.23 Å2
Index of Refraction: 1.54
Molar Refractivity: 99.89 cm3
Molar Volume: 317.9 cm3
Surface Tension: 39.1 dyne/cm
Density: 1.13 g/cm3
Flash Point: 292 °C
Enthalpy of Vaporization: 84.15 kJ/mol
Boiling Point: 559.3 °C at 760 mmHg
Vapour Pressure: 1.54E-12 mmHg at 25°C 
SMILES: O=C(NCCc1cc(OC)c(OC)cc1)Cc2ccc(OC)c(OC)c2
InChI: InChI=1/C20H25NO5/c1-23-16-7-5-14(11-18(16)25-3)9-10-21-20(22)13-15-6-8-17(24-2)19(12-15)26-4/h5-8,11-12H,9-10,13H2,1-4H3,(H,21,22)
InChIKey: KDIKNBJFJOYFNY-UHFFFAOYAD
Std. InChI: InChI=1S/C20H25NO5/c1-23-16-7-5-14(11-18(16)25-3)9-10-21-20(22)13-15-6-8-17(24-2)19(12-15)26-4/h5-8,11-12H,9-10,13H2,1-4H3,(H,21,22)
Std. InChIKey: KDIKNBJFJOYFNY-UHFFFAOYSA-N