Name: Name:3,5-dimethyl-1-benzothiophene-2-carboxylic acid
Brand: Angene
SKU: AG01BEUV
Rating: 90 (10 reviews)

3,5-dimethyl-1-benzothiophene-2-carboxylic acid

CAS No.:

6179-20-0

Catalog Number:

AG01BEUV

Molecular Formula:

C11H10O2S

Molecular Weight:

206.2609

Catalog Number:

AG01BEUV

Chemical Name:

3,5-dimethyl-1-benzothiophene-2-carboxylic acid

CAS Number:

6179-20-0

Molecular Formula:

C11H10O2S

Molecular Weight:

206.2609

MDL Number:

MFCD11207695

IUPAC Name:

3,5-dimethyl-1-benzothiophene-2-carboxylic acid

InChI:

InChI=1S/C11H10O2S/c1-6-3-4-9-8(5-6)7(2)10(14-9)11(12)13/h3-5H,1-2H3,(H,12,13)

InChI Key:

PYPHCGKGCYJPCN-UHFFFAOYSA-N

SMILES:

Cc1ccc2c(c1)c(C)c(s2)C(=O)O

Complexity:

241

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

206.04g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

206.259g/mol

Monoisotopic Mass:

206.04g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

65.5A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5