Name: Name:2-oxo-1-(propan-2-yl)-1,2-dihydropyridine-4-carboxylic acid
Brand: Angene
SKU: AG00IKZV
Rating: 90 (10 reviews)

2-oxo-1-(propan-2-yl)-1,2-dihydropyridine-4-carboxylic acid

CAS No.:

1203544-02-8

Catalog Number:

AG00IKZV

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

Catalog Number:

AG00IKZV

Chemical Name:

2-oxo-1-(propan-2-yl)-1,2-dihydropyridine-4-carboxylic acid

CAS Number:

1203544-02-8

Molecular Formula:

C9H11NO3

Molecular Weight:

181.1885

MDL Number:

MFCD26096892

IUPAC Name:

2-oxo-1-propan-2-ylpyridine-4-carboxylic acid

InChI:

InChI=1S/C9H11NO3/c1-6(2)10-4-3-7(9(12)13)5-8(10)11/h3-6H,1-2H3,(H,12,13)

InChI Key:

FRMULVSYTSBJHX-UHFFFAOYSA-N

SMILES:

OC(=O)c1ccn(c(=O)c1)C(C)C

Complexity:

302

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

181.074g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

181.191g/mol

Monoisotopic Mass:

181.074g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

57.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

0.4