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1020253-05-7 | Benzenesulfonamide, 4-bromo-N-butyl-3-(trifluoromethyl)-
CAS No: 1020253-05-7 Catalog No: AG0006DD MDL No:MFCD09972161
Product Description
Catalog Number:
AG0006DD
Chemical Name:
Benzenesulfonamide, 4-bromo-N-butyl-3-(trifluoromethyl)-
CAS Number:
1020253-05-7
Molecular Formula:
C11H13BrF3NO2S
Molecular Weight:
360.1906
MDL Number:
MFCD09972161
IUPAC Name:
4-bromo-N-butyl-3-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C11H13BrF3NO2S/c1-2-3-6-16-19(17,18)8-4-5-10(12)9(7-8)11(13,14)15/h4-5,7,16H,2-3,6H2,1H3
InChI Key:
BULCCCDZIBVCBO-UHFFFAOYSA-N
SMILES:
CCCCNS(=O)(=O)c1ccc(c(c1)C(F)(F)F)Br
Properties
Complexity:
380
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
358.98g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.189g/mol
Monoisotopic Mass:
358.98g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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