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3-Bromo-N-butyl-5-methylbenzenesulfonamide

HCID 46738696
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Basic information

CAS
1020252-93-0
Standard SMILES
CCCCNS(=O)(=O)c1cc(C)cc(Br)c1
InChIKey
PFYFYGOHARPIMD-UHFFFAOYSA-N
Molecular formula
C11H16BrNO2S
Average molar mass
306.22 g/mol
Monoisotopic mass
305.00851

Names & identifiers

Preferred name
3-Bromo-N-butyl-5-methylbenzenesulfonamide
IUPAC
3-bromo-N-butyl-5-methylbenzenesulfonamide
English name
N-Butyl3-broMo-5-MethylbenzenesulfonaMide
Molecular formula
C11H16BrNO2S
Molecular weight
306.21924

Names & synonyms

1020252-93-03-Bromo-N-butyl-5-methylbenzenesulfonamideN-BUTYL 3-BROMO-5-METHYLBENZENESULFONAMIDEMFCD09972149Benzenesulfonamide, 3-bromo-N-butyl-5-methyl-DTXSID10674352AKOS015834244BS-19191DB-3714493-bromo-N-butyl-5-methyl-benzenesulfonamideCS-02123373-Bromo-N-butyl-5-methylbenzene-1-sulfonamide
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N-BUTYL-3-BROMO-5-METHYLBENZENESULFONAMIDE

Database identifiers

CAS
1020252-93-0
PubChem CID
46738696
DTXSID
DTXSID10674352

Properties

Computed structural propertiesFilling in

XLogP
3.2
Topological polar surface area
54.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
300

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