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26957-91-5 | 4-Bromo-N-(2-bromoethyl)benzenesulfonamide
CAS No: 26957-91-5 Catalog No: AG01F3B5 MDL No:
Product Description
Catalog Number:
AG01F3B5
Chemical Name:
4-Bromo-N-(2-bromoethyl)benzenesulfonamide
CAS Number:
26957-91-5
Molecular Formula:
C8H9Br2NO2S
Molecular Weight:
343.0356
IUPAC Name:
4-bromo-N-(2-bromoethyl)benzenesulfonamide
InChI:
InChI=1S/C8H9Br2NO2S/c9-5-6-11-14(12,13)8-3-1-7(10)2-4-8/h1-4,11H,5-6H2
InChI Key:
JOKHRUBCIMJWHS-UHFFFAOYSA-N
SMILES:
BrCCNS(=O)(=O)c1ccc(cc1)Br
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
342.87g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
343.033g/mol
Monoisotopic Mass:
340.872g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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