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20721-09-9 | Benzoic acid, 4-[(4-bromophenyl)sulfonyl]-, hydrazide
CAS No: 20721-09-9 Catalog No: AG002IWN MDL No:
Product Description
Catalog Number:
AG002IWN
Chemical Name:
Benzoic acid, 4-[(4-bromophenyl)sulfonyl]-, hydrazide
CAS Number:
20721-09-9
Molecular Formula:
C13H11BrN2O3S
Molecular Weight:
355.2070
IUPAC Name:
4-(4-bromophenyl)sulfonylbenzohydrazide
InChI:
InChI=1S/C13H11BrN2O3S/c14-10-3-7-12(8-4-10)20(18,19)11-5-1-9(2-6-11)13(17)16-15/h1-8H,15H2,(H,16,17)
InChI Key:
WRNNOFKDLSSNFA-UHFFFAOYSA-N
SMILES:
NNC(=O)c1ccc(cc1)S(=O)(=O)c1ccc(cc1)Br
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
353.967g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
355.206g/mol
Monoisotopic Mass:
353.967g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
97.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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