CAS
59307-41-4 Purity
96%
59307-41-4 Purity
96%
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3-Nitropyrrole
CAS
5930-94-9
Catalog Number
ACM5930949
Category
Other Products
Molecular Weight
112.09g/mol
Molecular Formula
C4H4N2O2
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Specification
IUPAC Name
3-nitro-1H-pyrrole
Canonical SMILES
C1=CNC=C1[N+](=O)[O-]
InChI
InChI=1S/C4H4N2O2/c7-6(8)4-1-2-5-3-4/h1-3,5H
InChI Key
LOJNBPNACKZWAI-UHFFFAOYSA-N
Complexity
98.7
Covalently-Bonded Unit Count
1
Exact Mass
112.027277g/mol
Formal Charge
0
H-Bond Acceptor
2
H-Bond Donor
1
Heavy Atom Count
8
Monoisotopic Mass
112.027277g/mol
Rotatable Bond Count
0
XLogP3
0.5
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