Home Halogens Benzoic acid, 2,4-dichloro-, 4-[(2,4-dichlorobenzoyl)amino]-3-methylphenyl ester

Benzoic acid, 2,4-dichloro-, 4-[(2,4-dichlorobenzoyl)amino]-3-methylphenyl ester

CAS No.:
1363166-08-8
Catalog Number:
AG0011MW
Molecular Formula:
C21H13Cl4NO3
Molecular Weight:
469.1448
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Product Description
Catalog Number:
AG0011MW
Chemical Name:
Benzoic acid, 2,4-dichloro-, 4-[(2,4-dichlorobenzoyl)amino]-3-methylphenyl ester
CAS Number:
1363166-08-8
Molecular Formula:
C21H13Cl4NO3
Molecular Weight:
469.1448
MDL Number:
MFCD21641332
IUPAC Name:
[4-[(2,4-dichlorobenzoyl)amino]-3-methylphenyl] 2,4-dichlorobenzoate
InChI:
InChI=1S/C21H13Cl4NO3/c1-11-8-14(29-21(28)16-6-3-13(23)10-18(16)25)4-7-19(11)26-20(27)15-5-2-12(22)9-17(15)24/h2-10H,1H3,(H,26,27)
InChI Key:
ZNGIXBMPSLXUOP-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)C(=O)Nc1ccc(cc1C)OC(=O)c1ccc(cc1Cl)Cl
Properties
Complexity:
592  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.962g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
469.139g/mol
Monoisotopic Mass:
466.965g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7  
Properties