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23008-56-2 | Benzenamine, N-(4-chlorophenyl)-2-nitro-
CAS No: 23008-56-2 Catalog No: AG002LU3 MDL No:MFCD02683544
Product Description
Catalog Number:
AG002LU3
Chemical Name:
Benzenamine, N-(4-chlorophenyl)-2-nitro-
CAS Number:
23008-56-2
Molecular Formula:
C12H9ClN2O2
Molecular Weight:
248.6651
MDL Number:
MFCD02683544
IUPAC Name:
N-(4-chlorophenyl)-2-nitroaniline
InChI:
InChI=1S/C12H9ClN2O2/c13-9-5-7-10(8-6-9)14-11-3-1-2-4-12(11)15(16)17/h1-8,14H
InChI Key:
RCLKXSIRDRWUGX-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)Nc1ccccc1[N+](=O)[O-]
EC Number:
245-377-4
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.035g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.666g/mol
Monoisotopic Mass:
248.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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