2-Butenoic acid, 3-(1-pyrrolidinyl)-, ethyl ester, (E)-


Chemical Name: 2-Butenoic acid, 3-(1-pyrrolidinyl)-, ethyl ester, (E)-
CAS Number: 54716-02-8
Product Number: AG0038NM(AGN-PC-0OC415)
Synonyms:
MDL No:
Molecular Formula: C10H17NO2
Molecular Weight: 183.2475

Identification/Properties


Computed Properties
Molecular Weight:
183.251g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
183.126g/mol
Monoisotopic Mass:
183.126g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
205
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:
Warning
UN#:
N/A
Hazard Statements:
H319
Precautionary Statements:
P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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