Name: Name:1H-Indole-2-carboxylic acid, 6-(methylthio)-, methyl ester
Brand: Angene
SKU: AG00I3ST
Rating: 90 (10 reviews)

1H-Indole-2-carboxylic acid, 6-(methylthio)-, methyl ester

CAS No.:

202584-20-1

Catalog Number:

AG00I3ST

Molecular Formula:

C11H11NO2S

Molecular Weight:

221.2755

Catalog Number:

AG00I3ST

Chemical Name:

1H-Indole-2-carboxylic acid, 6-(methylthio)-, methyl ester

CAS Number:

202584-20-1

Molecular Formula:

C11H11NO2S

Molecular Weight:

221.2755

MDL Number:

MFCD06653517

IUPAC Name:

methyl 6-methylsulfanyl-1H-indole-2-carboxylate

InChI:

InChI=1S/C11H11NO2S/c1-14-11(13)10-5-7-3-4-8(15-2)6-9(7)12-10/h3-6,12H,1-2H3

InChI Key:

WIDPUEXDDQAFTO-UHFFFAOYSA-N

SMILES:

COC(=O)c1cc2c([nH]1)cc(cc2)SC

Complexity:

247

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

221.051g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

221.274g/mol

Monoisotopic Mass:

221.051g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3: