Name: Name:4-Pyrimidinecarboxylic acid, 5-bromo-2-cyclopropyl-, methyl ester
Brand: Angene
SKU: AG000N0T
Rating: 90 (10 reviews)

4-Pyrimidinecarboxylic acid, 5-bromo-2-cyclopropyl-, methyl ester

CAS No.:

1250443-89-0

Catalog Number:

AG000N0T

Molecular Formula:

C9H9BrN2O2

Molecular Weight:

257.0840

Catalog Number:

AG000N0T

Chemical Name:

4-Pyrimidinecarboxylic acid, 5-bromo-2-cyclopropyl-, methyl ester

CAS Number:

1250443-89-0

Molecular Formula:

C9H9BrN2O2

Molecular Weight:

257.0840

MDL Number:

MFCD16987750

IUPAC Name:

methyl 5-bromo-2-cyclopropylpyrimidine-4-carboxylate

InChI:

InChI=1S/C9H9BrN2O2/c1-14-9(13)7-6(10)4-11-8(12-7)5-2-3-5/h4-5H,2-3H2,1H3

InChI Key:

UNTJFTYLMTYCGQ-UHFFFAOYSA-N

SMILES:

COC(=O)c1nc(ncc1Br)C1CC1

Complexity:

233

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

255.985g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

257.087g/mol

Monoisotopic Mass:

255.985g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7