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114578-36-8 | 3-Butenoic acid, hydrazide
CAS No: 114578-36-8 Catalog No: AG000EQ8 MDL No:
Product Description
Catalog Number:
AG000EQ8
Chemical Name:
3-Butenoic acid, hydrazide
CAS Number:
114578-36-8
Molecular Formula:
C4H8N2O
Molecular Weight:
100.1191
IUPAC Name:
but-3-enehydrazide
InChI:
InChI=1S/C4H8N2O/c1-2-3-4(7)6-5/h2H,1,3,5H2,(H,6,7)
InChI Key:
WFKVRCILUKAVTF-UHFFFAOYSA-N
SMILES:
NNC(=O)CC=C
Properties
Complexity:
79.8
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
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:
2
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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