Name: Name:Benzo[b]thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-, ethyl ester
Brand: Angene
SKU: AG002GDF
Rating: 90 (10 reviews)

Benzo[b]thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-, ethyl ester

CAS No.:

19282-45-2

Catalog Number:

AG002GDF

Molecular Formula:

C11H14O2S

Molecular Weight:

210.2927

Catalog Number:

AG002GDF

Chemical Name:

Benzo[b]thiophene-2-carboxylic acid, 4,5,6,7-tetrahydro-, ethyl ester

CAS Number:

19282-45-2

Molecular Formula:

C11H14O2S

Molecular Weight:

210.2927

MDL Number:

MFCD06662278

IUPAC Name:

ethyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

InChI:

InChI=1S/C11H14O2S/c1-2-13-11(12)10-7-8-5-3-4-6-9(8)14-10/h7H,2-6H2,1H3

InChI Key:

BNSTWYGMSUJOFU-UHFFFAOYSA-N

SMILES:

CCOC(=O)c1cc2c(s1)CCCC2

Complexity:

217

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

210.071g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

210.291g/mol

Monoisotopic Mass:

210.071g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

54.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.4