3-bromo-4-fluoro-N,N-dimethylbenzenesulfonamide

3-bromo-4-fluoro-N,N-dimethylbenzenesulfonamide

CAS: 1240287-91-5

Formula: C8H9BrFNO2S

SMILES: CN(C)S(=O)(=O)C1=CC=C(F)C(Br)=C1

IUPAC: 3-bromo-4-fluoro-N,N-dimethylbenzene-1-sulfonamide

InChI: InChI=1S/C8H9BrFNO2S/c1-11(2)14(12,13)6-3-4-8(10)7(9)5-6/h3-5H,1-2H3

Composition: C (34.06%), H (3.22%), Br (28.32%), F (6.73%), N (4.96%), O (11.34%), S (11.36%)

Molar Mass: 282.13

Atom Count: 23

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	280.952141
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	UEIQIHHUAPFUBL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.85
Topological Polar Surface Area	37.38
Polarizability	22.04
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	1240287-91-5		$128.10-$2,831.18$128.10$217.86$589.99$2,831.18