Name: Name:1H-Indole-2-carboxylicacid, 3-formyl-5-methyl-
Brand: Angene
SKU: AG0056O4
Rating: 90 (10 reviews)

1H-Indole-2-carboxylicacid, 3-formyl-5-methyl-

CAS No.:

842971-74-8

Catalog Number:

AG0056O4

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

Catalog Number:

AG0056O4

Chemical Name:

1H-Indole-2-carboxylicacid, 3-formyl-5-methyl-

CAS Number:

842971-74-8

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

MDL Number:

MFCD06800773

IUPAC Name:

3-formyl-5-methyl-1H-indole-2-carboxylic acid

InChI:

InChI=1S/C11H9NO3/c1-6-2-3-9-7(4-6)8(5-13)10(12-9)11(14)15/h2-5,12H,1H3,(H,14,15)

InChI Key:

BMVNZBKQRRYJSV-UHFFFAOYSA-N

SMILES:

O=Cc1c([nH]c2c1cc(C)cc2)C(=O)O

Complexity:

279

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

203.058g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

203.197g/mol

Monoisotopic Mass:

203.058g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7