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

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

Formula: C11H8BrClO4S

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

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

InChI: InChI=1S/C11H8BrClO4S/c1-16-5-3-4(12)6-7(13)10(11(14)15)18-9(6)8(5)17-2/h3H,1-2H3,(H,14,15)

Composition: C (37.58%), H (2.29%), Br (22.73%), Cl (10.08%), O (18.20%), S (9.12%)

Molar Mass: 351.6

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	349.901521
Formal Charge	0
FSP3	0.18
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	JWZLPHFKHWQIFL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.79
Topological Polar Surface Area	55.76
Polarizability	28.83
Ring Count	2
Rotatable Bond Count	3

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C11H8BrClO4S		$400.00-$4,136.00$400.00$2,200.00$4,136.00