944902-44-7
[4-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]ACETIC ACID
Name[4-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]ACETIC ACID
1Identification
【Name】
[4-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]ACETIC ACID
【CAS】
【MDL】
MFCD10697183
【English Synonyms】
【Formula】
C7 H4 Cl F3 N2 O2
【MolWeight】
240.568
【Inchi】
InChI=1S/C7H4ClF3N2O2/c8-4-1-3(7(9,10)11)12-5(13-4)2-6(14)15/h1H,2H2,(H,14,15)
【InChIKey】
InChIKey=QTAIBDJEBBYTAN-UHFFFAOYSA-N
【SMILES】
c1c(nc(nc1Cl)CC(=O)O)C(F)(F)F
【MOL File】
[4-CHLORO-6-(TRIFLUO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
[4-CHLORO-6-(TRIFLUOROMETHYL)PYRIMIDIN-2-YL]ACETIC ACID.cml