Name: Name:5-Pyrimidinecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, cyclopropylmethyl ester
Brand: Angene
SKU: AG0020AQ
Rating: 90 (10 reviews)

5-Pyrimidinecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, cyclopropylmethyl ester

CAS No.:

175137-31-2

Catalog Number:

AG0020AQ

Molecular Formula:

C10H8ClF3N2O2

Molecular Weight:

280.6309

Catalog Number:

AG0020AQ

Chemical Name:

5-Pyrimidinecarboxylic acid, 2-chloro-4-(trifluoromethyl)-, cyclopropylmethyl ester

CAS Number:

175137-31-2

Molecular Formula:

C10H8ClF3N2O2

Molecular Weight:

280.6309

MDL Number:

MFCD00068151

IUPAC Name:

cyclopropylmethyl 2-chloro-4-(trifluoromethyl)pyrimidine-5-carboxylate

InChI:

InChI=1S/C10H8ClF3N2O2/c11-9-15-3-6(7(16-9)10(12,13)14)8(17)18-4-5-1-2-5/h3,5H,1-2,4H2

InChI Key:

VAQJVLCEIMTYHZ-UHFFFAOYSA-N

SMILES:

Clc1ncc(c(n1)C(F)(F)F)C(=O)OCC1CC1

Complexity:

323

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

280.023g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

280.631g/mol

Monoisotopic Mass:

280.023g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

52.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7