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15846-25-0 | 2-Butenamide, 3-amino-
CAS No: 15846-25-0 Catalog No: AG001Q7Q MDL No:
Product Description
Catalog Number:
AG001Q7Q
Chemical Name:
2-Butenamide, 3-amino-
CAS Number:
15846-25-0
Molecular Formula:
C4H8N2O
Molecular Weight:
100.1191
IUPAC Name:
(Z)-3-aminobut-2-enamide
InChI:
InChI=1S/C4H8N2O/c1-3(5)2-4(6)7/h2H,5H2,1H3,(H2,6,7)/b3-2-
InChI Key:
UAUSQEVPWPGBHG-IHWYPQMZSA-N
SMILES:
CC(=CC(=O)N)N
EC Number:
239-956-0
Properties
Complexity:
106
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
100.064g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
100.121g/mol
Monoisotopic Mass:
100.064g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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