3-chloro-4-fluoro-6,7-dimethoxy-1-benzothiophene-2-carboxylic acid

3-chloro-4-fluoro-6,7-dimethoxy-1-benzothiophene-2-carboxylic acid

Formula: C11H8ClFO4S

SMILES: COC1=CC(F)=C2C(Cl)=C(SC2=C1OC)C(O)=O

IUPAC: 3-chloro-4-fluoro-6,7-dimethoxy-1-benzothiophene-2-carboxylic acid

InChI: InChI=1S/C11H8ClFO4S/c1-16-5-3-4(13)6-7(12)10(11(14)15)18-9(6)8(5)17-2/h3H,1-2H3,(H,14,15)

Composition: C (45.45%), H (2.77%), Cl (12.20%), F (6.54%), O (22.02%), S (11.03%)

Molar Mass: 290.69

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	289.9815858
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	XQXCROFBAWSNDH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.39
Topological Polar Surface Area	55.76
Polarizability	25.66
Ring Count	2
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C11H8ClFO4S		$360.00-$4,136.00$360.00$2,200.00$4,136.00