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4-amino-3-methylbenzenesulfonamide

4-amino-3-methylbenzenesulfonamide

CAS: 53297-70-4

Formula: C7H10N2O2S

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

IUPAC: 4-amino-3-methylbenzene-1-sulfonamide

InChI: InChI=1S/C7H10N2O2S/c1-5-4-6(12(9,10)11)2-3-7(5)8/h2-4H,8H2,1H3,(H2,9,10,11)

Composition: C (45.15%), H (5.41%), N (15.04%), O (17.18%), S (17.22%)

Molar Mass: 186.23

Atom Count: 22

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.046298744
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey IGQGXIVCGKMRAM-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.96
Topological Polar Surface Area 86.18
Polarizability 18.54
Ring Count 1
Rotatable Bond Count 1

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