Acetic acid, cyano-, 2-ethoxyethyl ester


Chemical Name: Acetic acid, cyano-, 2-ethoxyethyl ester
CAS Number: 32804-77-6
Product Number: AG003H6F(AGN-PC-0JLO68)
Synonyms:
MDL No:
Molecular Formula: C7H11NO3
Molecular Weight: 157.1671

Identification/Properties


Properties
BP:
277.2°C at 760 mmHg
Form:
Liquid
Computed Properties
Molecular Weight:
157.169g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
157.074g/mol
Monoisotopic Mass:
157.074g/mol
Topological Polar Surface Area:
59.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
158
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302+H312+H332-H315-H319
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312+P330-P302+P352+P312+P362+P364-P304+P340+P312-P305+P351+P338+P337+P313-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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