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189083-11-2 | 1,4-Benzenedicarboxamide, N1,N4-bis(2,4,6-trichlorophenyl)-
CAS No: 189083-11-2 Catalog No: AG002HUY MDL No:
Product Description
Catalog Number:
AG002HUY
Chemical Name:
1,4-Benzenedicarboxamide, N1,N4-bis(2,4,6-trichlorophenyl)-
CAS Number:
189083-11-2
Molecular Formula:
C20H10Cl6N2O2
Molecular Weight:
523.0236
IUPAC Name:
1-N,4-N-bis(2,4,6-trichlorophenyl)benzene-1,4-dicarboxamide
InChI:
InChI=1S/C20H10Cl6N2O2/c21-11-5-13(23)17(14(24)6-11)27-19(29)9-1-2-10(4-3-9)20(30)28-18-15(25)7-12(22)8-16(18)26/h1-8H,(H,27,29)(H,28,30)
InChI Key:
CEDFTHBOQZSICP-UHFFFAOYSA-N
SMILES:
O=C(c1ccc(cc1)C(=O)Nc1c(Cl)cc(cc1Cl)Cl)Nc1c(Cl)cc(cc1Cl)Cl
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
521.884g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
523.012g/mol
Monoisotopic Mass:
519.887g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.4
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