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87666-60-2 | [1,1'-Biphenyl]-2-amine, 3-nitro-
CAS No: 87666-60-2 Catalog No: AG004H6F MDL No:
Product Description
Catalog Number:
AG004H6F
Chemical Name:
[1,1'-Biphenyl]-2-amine, 3-nitro-
CAS Number:
87666-60-2
Molecular Formula:
C12H10N2O2
Molecular Weight:
214.2200
IUPAC Name:
2-nitro-6-phenylaniline
InChI:
InChI=1S/C12H10N2O2/c13-12-10(9-5-2-1-3-6-9)7-4-8-11(12)14(15)16/h1-8H,13H2
InChI Key:
YNUSHIPXRLCOCK-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1N)c1ccccc1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.074g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
214.224g/mol
Monoisotopic Mass:
214.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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