3-fluoro-4-methanesulfonylaniline

3-fluoro-4-methanesulfonylaniline

CAS: 252561-34-5

Formula: C7H8FNO2S

SMILES: CS(=O)(=O)C1=C(F)C=C(N)C=C1

IUPAC: 3-fluoro-4-methanesulfonylaniline

InChI: InChI=1S/C7H8FNO2S/c1-12(10,11)7-3-2-5(9)4-6(7)8/h2-4H,9H2,1H3

Composition: C (44.44%), H (4.26%), F (10.04%), N (7.40%), O (16.91%), S (16.94%)

Molar Mass: 189.2

Atom Count: 20

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	189.025977839
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	WSARYNAINPBAEY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.98
Topological Polar Surface Area	60.16
Polarizability	17.22
Ring Count	1
Rotatable Bond Count	1

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