4-amino-3,7-dichloro-1-benzothiophene-2-carboxylic acid

4-amino-3,7-dichloro-1-benzothiophene-2-carboxylic acid

Formula: C9H5Cl2NO2S

SMILES: NC1=C2C(Cl)=C(SC2=C(Cl)C=C1)C(O)=O

IUPAC: 4-amino-3,7-dichloro-1-benzothiophene-2-carboxylic acid

InChI: InChI=1S/C9H5Cl2NO2S/c10-3-1-2-4(12)5-6(11)8(9(13)14)15-7(3)5/h1-2H,12H2,(H,13,14)

Composition: C (41.24%), H (1.92%), Cl (27.05%), N (5.34%), O (12.21%), S (12.23%)

Molar Mass: 262.1

Atom Count: 20

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	260.941805
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	FANAVTGIBPGWRX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.75
Topological Polar Surface Area	63.32
Polarizability	23.87
Ring Count	2
Rotatable Bond Count	1

Suppliers

Struchem co.,ltd

Supplier Profile

Purity	LeadTime	Formula	PacketSize	UnitPrice
95%	<5 Days	C9H5Cl2NO2S		$643.00-$4,136.00$643.00$2,200.00$4,136.00