Name: Name:Benzo[b]thiophene-2-carboxylic acid, 7-chloro-3-hydroxy-, ethyl ester
Brand: Angene
SKU: AG0023YV
Rating: 90 (10 reviews)

Benzo[b]thiophene-2-carboxylic acid, 7-chloro-3-hydroxy-, ethyl ester

CAS No.:

1825392-01-5

Catalog Number:

AG0023YV

Molecular Formula:

C11H9ClO3S

Molecular Weight:

256.7054

Catalog Number:

AG0023YV

Chemical Name:

Benzo[b]thiophene-2-carboxylic acid, 7-chloro-3-hydroxy-, ethyl ester

CAS Number:

1825392-01-5

Molecular Formula:

C11H9ClO3S

Molecular Weight:

256.7054

MDL Number:

MFCD29044877

IUPAC Name:

ethyl 7-chloro-3-hydroxy-1-benzothiophene-2-carboxylate

InChI:

InChI=1S/C11H9ClO3S/c1-2-15-11(14)10-8(13)6-4-3-5-7(12)9(6)16-10/h3-5,13H,2H2,1H3

InChI Key:

VVZADVLESMRACU-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1sc2c(c1O)cccc2Cl

Complexity:

274

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.996g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

256.7g/mol

Monoisotopic Mass:

255.996g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.3