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89770-26-3 | 4-Quinolinamine, 8-nitro-
CAS No: 89770-26-3 Catalog No: AG0040IK MDL No:
Product Description
Catalog Number:
AG0040IK
Chemical Name:
4-Quinolinamine, 8-nitro-
CAS Number:
89770-26-3
Molecular Formula:
C9H7N3O2
Molecular Weight:
189.1708
IUPAC Name:
8-nitroquinolin-4-amine
InChI:
InChI=1S/C9H7N3O2/c10-7-4-5-11-9-6(7)2-1-3-8(9)12(13)14/h1-5H,(H2,10,11)
InChI Key:
KHXNBKYPUALXTE-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc2c1nccc2N
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.054g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
189.174g/mol
Monoisotopic Mass:
189.054g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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