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13115-28-1 | 2-Naphthalenamine, 3-nitro-
CAS No: 13115-28-1 Catalog No: AG000VN1 MDL No:
Product Description
Catalog Number:
AG000VN1
Chemical Name:
2-Naphthalenamine, 3-nitro-
CAS Number:
13115-28-1
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
IUPAC Name:
3-nitronaphthalen-2-amine
InChI:
InChI=1S/C10H8N2O2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12(13)14/h1-6H,11H2
InChI Key:
ZAXOISFBCDOZER-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2ccccc2cc1N
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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