2-Butenoic acid, 3-amino-, 1-methylethyl ester


Chemical Name: 2-Butenoic acid, 3-amino-, 1-methylethyl ester
CAS Number: 14205-46-0
Product Number: AG001HNI(AGN-PC-0BIPSX)
Synonyms:
MDL No: MFCD00134272
Molecular Formula: C7H13NO2
Molecular Weight: 143.1836

Identification/Properties


Properties
MP:
19-23°C
BP:
80°C/1mmHg(lit.)
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Refractive Index:
1.4870 to 1.4910
Computed Properties
Molecular Weight:
143.186g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
143.095g/mol
Monoisotopic Mass:
143.095g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
150
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3267
Hazard Statements:
H314-H335
Precautionary Statements:
P261-P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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