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99177-40-9 | 4-tert-butyl-2-bromobenzene sulfonamide
CAS No: 99177-40-9 Catalog No: AG01F090 MDL No:MFCD12026249
Product Description
Catalog Number:
AG01F090
Chemical Name:
4-tert-butyl-2-bromobenzene sulfonamide
CAS Number:
99177-40-9
Molecular Formula:
C10H14BrNO2S
Molecular Weight:
292.1927
MDL Number:
MFCD12026249
IUPAC Name:
2-bromo-4-tert-butylbenzenesulfonamide
InChI:
InChI=1S/C10H14BrNO2S/c1-10(2,3)7-4-5-9(8(11)6-7)15(12,13)14/h4-6H,1-3H3,(H2,12,13,14)
InChI Key:
VISBKQOZQQEHDJ-UHFFFAOYSA-N
SMILES:
Brc1cc(ccc1S(=O)(=O)N)C(C)(C)C
Properties
Complexity:
315
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.993g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
292.191g/mol
Monoisotopic Mass:
290.993g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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