Name: Name:1-methanesulfonyl-2-methyl-2,3-dihydro-1H-indole-5-carboxylic acid
Brand: Angene
SKU: AG00IDJK
Rating: 90 (10 reviews)

1-methanesulfonyl-2-methyl-2,3-dihydro-1H-indole-5-carboxylic acid

CAS No.:

851116-22-8

Catalog Number:

AG00IDJK

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

Catalog Number:

AG00IDJK

Chemical Name:

1-methanesulfonyl-2-methyl-2,3-dihydro-1H-indole-5-carboxylic acid

CAS Number:

851116-22-8

Molecular Formula:

C11H13NO4S

Molecular Weight:

255.2902

MDL Number:

MFCD06655804

IUPAC Name:

2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid

InChI:

InChI=1S/C11H13NO4S/c1-7-5-9-6-8(11(13)14)3-4-10(9)12(7)17(2,15)16/h3-4,6-7H,5H2,1-2H3,(H,13,14)

InChI Key:

CACJWHAAEBJJHE-UHFFFAOYSA-N

SMILES:

CC1Cc2c(N1S(=O)(=O)C)ccc(c2)C(=O)O

Complexity:

414

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.057g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

255.288g/mol

Monoisotopic Mass:

255.057g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

83.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.1