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88340-32-3 | Benzoic acid, 4-[(4-methylbenzoyl)amino]-, 4-methylphenyl ester
CAS No: 88340-32-3 Catalog No: AG0046P9 MDL No:
Product Description
Catalog Number:
AG0046P9
Chemical Name:
Benzoic acid, 4-[(4-methylbenzoyl)amino]-, 4-methylphenyl ester
CAS Number:
88340-32-3
Molecular Formula:
C22H19NO3
Molecular Weight:
345.3912
IUPAC Name:
(4-methylphenyl) 4-[(4-methylbenzoyl)amino]benzoate
InChI:
InChI=1S/C22H19NO3/c1-15-3-7-17(8-4-15)21(24)23-19-11-9-18(10-12-19)22(25)26-20-13-5-16(2)6-14-20/h3-14H,1-2H3,(H,23,24)
InChI Key:
BKNOPVTYEMKCHA-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)OC(=O)c1ccc(cc1)NC(=O)c1ccc(cc1)C
Properties
Complexity:
468
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
345.136g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
345.398g/mol
Monoisotopic Mass:
345.136g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
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