Name: Name:5-Pyrimidinecarboxylic acid, 2-methyl-4-(1-methylethyl)-
Brand: Angene
SKU: AG000XM4
Rating: 90 (10 reviews)

5-Pyrimidinecarboxylic acid, 2-methyl-4-(1-methylethyl)-

CAS No.:

127958-08-1

Catalog Number:

AG000XM4

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

Catalog Number:

AG000XM4

Chemical Name:

5-Pyrimidinecarboxylic acid, 2-methyl-4-(1-methylethyl)-

CAS Number:

127958-08-1

Molecular Formula:

C9H12N2O2

Molecular Weight:

180.2038

MDL Number:

MFCD09260323

IUPAC Name:

2-methyl-4-propan-2-ylpyrimidine-5-carboxylic acid

InChI:

InChI=1S/C9H12N2O2/c1-5(2)8-7(9(12)13)4-10-6(3)11-8/h4-5H,1-3H3,(H,12,13)

InChI Key:

RZGODGDGIONWIW-UHFFFAOYSA-N

SMILES:

CC(c1nc(C)ncc1C(=O)O)C

Complexity:

194

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.09g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.207g/mol

Monoisotopic Mass:

180.09g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3