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61038-96-8

Basic Information
CAS No.: 61038-96-8
Name: 3-[N,N-Bis(methoxycarbonylethyl)]amino-acetanilide
Molecular Structure:
Molecular Structure of 61038-96-8 (3-[N,N-Bis(methoxycarbonylethyl)]amino-acetanilide)
Formula: C16H22 N2 O5
Molecular Weight: 322.36
Synonyms: m-Acetamido-N,N-bis[2-(methoxycarbonyl)ethyl]aniline;m-Acetylamino-N,N-bis(b-methoxycarbonylethyl)aniline; m-[Bis(b-carbomethoxyethyl)amino]acetanilide
EINECS: 262-565-1
Density: 1.209 g/cm3
Boiling Point: 511.7 °C at 760 mmHg
Flash Point: 263.3 °C
PSA: 84.94000
LogP: 1.65060
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Chemistry

IUPAC Name: Methyl 3-(3-acetamido-N-(3-methoxy-3-oxopropyl)anilino)propanoate 
Following is the structure of b-Alanine,N-[3-(acetylamino)phenyl]-N-(3-methoxy-3-oxopropyl)-, methyl ester (CAS NO.61038-96-8):
                       
Empirical Formula: C16H22N2O5
Molecular Weight: 322.3563
EINECS: 262-565-1
Index of Refraction: 1.56
Molar Refractivity: 86.18 cm3
Molar Volume: 266.5 cm3
Polarizability: 34.16 10-24cm3
Surface Tension: 47.9 dyne/cm
Density: 1.209 g/cm3
Flash Point: 263.3 °C
Enthalpy of Vaporization: 78.27 kJ/mol
Boiling Point: 511.7 °C at 760 mmHg
Vapour Pressure: 1.39E-10 mmHg at 25 °C
Product Categories of b-Alanine,N-[3-(acetylamino)phenyl]-N-(3-methoxy-3-oxopropyl)-, methyl ester (CAS NO.61038-96-8): Intermediates of Dyes and Pigments; Phenoles and thiophenoles
Canonical SMILES: CC(=O)NC1=CC(=CC=C1)N(CCC(=O)OC)CCC(=O)OC
InChI: InChI=1S/C16H22N2O5/c1-12(19)17-13-5-4-6-14(11-13)18(9-7-15(20)22-2)10-8-16(21)23-3/h4-6,11H,7-10H2,1-3H3,(H,17,19)
InChIKey: SXJIGSGZTVVZEB-UHFFFAOYSA-N

Specification

 b-Alanine,N-[3-(acetylamino)phenyl]-N-(3-methoxy-3-oxopropyl)-, methyl ester , its cas register number 61038-96-8. It also can be called 3-[N,N-Bis(methoxycarbonylethyl)]amino-acetanilide ; Methyl 3-[(3-acetamidophenyl)-(3-methoxy-3-oxopropyl)amino]propanoate ; and N-(3-(Acetylamino)phenyl)-N-(2-carboxyethyl)-beta-alanine dimethyl ester .