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1020253-06-8 | Benzenesulfonamide, 4-bromo-N-(1,1-dimethylethyl)-3-(trifluoromethyl)-
CAS No: 1020253-06-8 Catalog No: AG0006DC MDL No:MFCD09972162
Product Description
Catalog Number:
AG0006DC
Chemical Name:
Benzenesulfonamide, 4-bromo-N-(1,1-dimethylethyl)-3-(trifluoromethyl)-
CAS Number:
1020253-06-8
Molecular Formula:
C11H13BrF3NO2S
Molecular Weight:
360.1906
MDL Number:
MFCD09972162
IUPAC Name:
4-bromo-N-tert-butyl-3-(trifluoromethyl)benzenesulfonamide
InChI:
InChI=1S/C11H13BrF3NO2S/c1-10(2,3)16-19(17,18)7-4-5-9(12)8(6-7)11(13,14)15/h4-6,16H,1-3H3
InChI Key:
LOERVVBCAYSQDS-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1C(F)(F)F)S(=O)(=O)NC(C)(C)C
Properties
Complexity:
411
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:
3
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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