2-chloro-4-(fluorosulfonyl)benzoic acid

2-chloro-4-(fluorosulfonyl)benzoic acid

CAS: 1934852-61-5

Formula: C7H4ClFO4S

SMILES: OC(=O)C1=CC=C(C=C1Cl)S(F)(=O)=O

IUPAC: 2-chloro-4-(fluorosulfonyl)benzoic acid

InChI: InChI=1S/C7H4ClFO4S/c8-6-3-4(14(9,12)13)1-2-5(6)7(10)11/h1-3H,(H,10,11)

Composition: C (35.24%), H (1.69%), Cl (14.86%), F (7.96%), O (26.82%), S (13.44%)

Molar Mass: 238.61

Atom Count: 18

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	237.9502856
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	BEXNYFYCTVODCD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.68
Topological Polar Surface Area	71.44
Polarizability	18.78
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	1934852-61-5		$196.35-$670.40$196.35$288.92$670.40

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1934852-61-5		$107.19-$482.96$107.19$180.32$482.96