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114522-01-9 | Benzenesulfonamide, 4-chloro-N-(10-chloro-9-phenanthrenyl)-
CAS No: 114522-01-9 Catalog No: AG000EM1 MDL No:
Product Description
Catalog Number:
AG000EM1
Chemical Name:
Benzenesulfonamide, 4-chloro-N-(10-chloro-9-phenanthrenyl)-
CAS Number:
114522-01-9
Molecular Formula:
C20H13Cl2NO2S
Molecular Weight:
402.2937
IUPAC Name:
4-chloro-N-(10-chlorophenanthren-9-yl)benzenesulfonamide
InChI:
InChI=1S/C20H13Cl2NO2S/c21-13-9-11-14(12-10-13)26(24,25)23-20-18-8-4-2-6-16(18)15-5-1-3-7-17(15)19(20)22/h1-12,23H
InChI Key:
CIEIRASJDZEYIO-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)S(=O)(=O)Nc1c(Cl)c2ccccc2c2c1cccc2
Properties
Complexity:
585
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
401.004g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
402.289g/mol
Monoisotopic Mass:
401.004g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.2
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