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89763-10-0 | Cyclohexanecarboxylic acid, 1-[(2-chlorobenzoyl)phenylamino]-
CAS No: 89763-10-0 Catalog No: AG0040PO MDL No:
Product Description
Catalog Number:
AG0040PO
Chemical Name:
Cyclohexanecarboxylic acid, 1-[(2-chlorobenzoyl)phenylamino]-
CAS Number:
89763-10-0
Molecular Formula:
C20H20ClNO3
Molecular Weight:
357.8307
IUPAC Name:
1-(N-(2-chlorobenzoyl)anilino)cyclohexane-1-carboxylic acid
InChI:
InChI=1S/C20H20ClNO3/c21-17-12-6-5-11-16(17)18(23)22(15-9-3-1-4-10-15)20(19(24)25)13-7-2-8-14-20/h1,3-6,9-12H,2,7-8,13-14H2,(H,24,25)
InChI Key:
GKVAPBJGKRHBOU-UHFFFAOYSA-N
SMILES:
Clc1ccccc1C(=O)N(C1(CCCCC1)C(=O)O)c1ccccc1
Properties
Complexity:
483
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
357.113g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
357.834g/mol
Monoisotopic Mass:
357.113g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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