Name: Name:7-amino-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid
Brand: Angene
SKU: AG01BF7A
Rating: 90 (10 reviews)

7-amino-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

CAS No.:

1545047-94-6

Catalog Number:

AG01BF7A

Molecular Formula:

C10H8N2O3

Molecular Weight:

204.1821

Catalog Number:

AG01BF7A

Chemical Name:

7-amino-1-oxo-1,2-dihydroisoquinoline-4-carboxylic acid

CAS Number:

1545047-94-6

Molecular Formula:

C10H8N2O3

Molecular Weight:

204.1821

MDL Number:

MFCD28118506

IUPAC Name:

7-amino-1-oxo-2H-isoquinoline-4-carboxylic acid

InChI:

InChI=1S/C10H8N2O3/c11-5-1-2-6-7(3-5)9(13)12-4-8(6)10(14)15/h1-4H,11H2,(H,12,13)(H,14,15)

InChI Key:

KZULTKFSEHKIDZ-UHFFFAOYSA-N

SMILES:

Nc1ccc2c(c1)c(=O)[nH]cc2C(=O)O

Complexity:

338

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

204.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

204.185g/mol

Monoisotopic Mass:

204.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

92.4A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

-0.1