Name: Name:Benzo[b]thiophene-2-carboxylic acid, 6-chloro-3-methoxy-
Brand: Angene
SKU: AG001T44
Rating: 90 (10 reviews)

Benzo[b]thiophene-2-carboxylic acid, 6-chloro-3-methoxy-

CAS No.:

1624260-45-2

Catalog Number:

AG001T44

Molecular Formula:

C10H7ClO3S

Molecular Weight:

242.6788

Catalog Number:

AG001T44

Chemical Name:

Benzo[b]thiophene-2-carboxylic acid, 6-chloro-3-methoxy-

CAS Number:

1624260-45-2

Molecular Formula:

C10H7ClO3S

Molecular Weight:

242.6788

IUPAC Name:

6-chloro-3-methoxy-1-benzothiophene-2-carboxylic acid

InChI:

InChI=1S/C10H7ClO3S/c1-14-8-6-3-2-5(11)4-7(6)15-9(8)10(12)13/h2-4H,1H3,(H,12,13)

InChI Key:

OZAHJNXWNQEYMF-UHFFFAOYSA-N

SMILES:

COc1c(sc2c1ccc(c2)Cl)C(=O)O

Complexity:

261

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

241.98g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

242.673g/mol

Monoisotopic Mass:

241.98g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4