Name: Name:5-bromo-2-(propan-2-yl)pyrimidine-4-carboxylic acid
Brand: Angene
SKU: AG01AFE7
Rating: 90 (10 reviews)

5-bromo-2-(propan-2-yl)pyrimidine-4-carboxylic acid

CAS No.:

1267301-54-1

Catalog Number:

AG01AFE7

Molecular Formula:

C8H9BrN2O2

Molecular Weight:

245.0733

Catalog Number:

AG01AFE7

Chemical Name:

5-bromo-2-(propan-2-yl)pyrimidine-4-carboxylic acid

CAS Number:

1267301-54-1

Molecular Formula:

C8H9BrN2O2

Molecular Weight:

245.0733

MDL Number:

MFCD11870590

IUPAC Name:

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

InChI:

InChI=1S/C8H9BrN2O2/c1-4(2)7-10-3-5(9)6(11-7)8(12)13/h3-4H,1-2H3,(H,12,13)

InChI Key:

ZRKAYXAEJJRSBK-UHFFFAOYSA-N

SMILES:

CC(c1ncc(c(n1)C(=O)O)Br)C

Complexity:

199

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

243.985g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

245.076g/mol

Monoisotopic Mass:

243.985g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

63.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.9