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79700-48-4 | 1H-Pyrrol-1-amine, N-(2-nitrophenyl)-
CAS No: 79700-48-4 Catalog No: AG0050UR MDL No:
Product Description
Catalog Number:
AG0050UR
Chemical Name:
1H-Pyrrol-1-amine, N-(2-nitrophenyl)-
CAS Number:
79700-48-4
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
IUPAC Name:
N-(2-nitrophenyl)pyrrol-1-amine
InChI:
InChI=1S/C10H9N3O2/c14-13(15)10-6-2-1-5-9(10)11-12-7-3-4-8-12/h1-8,11H
InChI Key:
MFNFKVHVROVEEF-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1Nn1cccc1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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