Name: Name:2-Methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Brand: Angene
SKU: AG00DCNA
Rating: 90 (10 reviews)

2-Methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

CAS No.:

54931-62-3

Catalog Number:

AG00DCNA

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

Catalog Number:

AG00DCNA

Chemical Name:

2-Methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

CAS Number:

54931-62-3

Molecular Formula:

C11H9NO3

Molecular Weight:

203.1941

MDL Number:

MFCD03030456

IUPAC Name:

2-methyl-1-oxoisoquinoline-4-carboxylic acid

InChI:

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

InChI Key:

NQDGBUUSUPLGHH-UHFFFAOYSA-N

SMILES:

OC(=O)c1cn(C)c(=O)c2c1cccc2

Complexity:

335

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:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.8