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2447-94-1 | Benzamide, 4-chloro-N-(2-methylphenyl)-
CAS No: 2447-94-1 Catalog No: AG002O9P MDL No:
Product Description
Catalog Number:
AG002O9P
Chemical Name:
Benzamide, 4-chloro-N-(2-methylphenyl)-
CAS Number:
2447-94-1
Molecular Formula:
C14H12ClNO
Molecular Weight:
245.7042
IUPAC Name:
4-chloro-N-(2-methylphenyl)benzamide
InChI:
InChI=1S/C14H12ClNO/c1-10-4-2-3-5-13(10)16-14(17)11-6-8-12(15)9-7-11/h2-9H,1H3,(H,16,17)
InChI Key:
ISNRJGRQYPRTGD-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)C(=O)Nc1ccccc1C
NSC Number:
74394
Properties
Complexity:
261
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.061g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
245.706g/mol
Monoisotopic Mass:
245.061g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| 4-Chloro-N-o-tolyl-benzamide. | Acta crystallographica. Section E, Structure reports online 20081001 |
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