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5-bromo-2-methylbenzenesulfonamide

5-bromo-2-methylbenzenesulfonamide

CAS: 56919-16-5

Formula: C7H8BrNO2S

SMILES: CC1=C(C=C(Br)C=C1)S(N)(=O)=O

IUPAC: 5-bromo-2-methylbenzene-1-sulfonamide

InChI: InChI=1S/C7H8BrNO2S/c1-5-2-3-6(8)4-7(5)12(9,10)11/h2-4H,1H3,(H2,9,10,11)

Composition: C (33.62%), H (3.22%), Br (31.95%), N (5.60%), O (12.79%), S (12.82%)

Molar Mass: 250.11

Atom Count: 20

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 248.945913
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey FXNSWDXUWUJLLI-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 50.88
Topological Polar Surface Area 60.16
Polarizability 20.31
Ring Count 1
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 56919-16-5 $114.07-$277.70$114.07$116.88$277.70
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