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34052-37-4 | (2-Chloro-5-nitrophenyl)(phenyl)methanone
CAS No: 34052-37-4 Catalog No: AG003GZG MDL No:MFCD00007295
Product Description
Catalog Number:
AG003GZG
Chemical Name:
(2-Chloro-5-nitrophenyl)(phenyl)methanone
CAS Number:
34052-37-4
Molecular Formula:
C13H8ClNO3
Molecular Weight:
261.6605
MDL Number:
MFCD00007295
IUPAC Name:
(2-chloro-5-nitrophenyl)-phenylmethanone
InChI:
InChI=1S/C13H8ClNO3/c14-12-7-6-10(15(17)18)8-11(12)13(16)9-4-2-1-3-5-9/h1-8H
InChI Key:
HRPHZUAPQWJPCZ-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1C(=O)c1ccccc1)[N+](=O)[O-]
EC Number:
251-811-3
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.019g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.661g/mol
Monoisotopic Mass:
261.019g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
62.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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