Home Halogens 4-chloro-6-methoxy-2-(trifluoromethyl)pyrimidine

4-chloro-6-methoxy-2-(trifluoromethyl)pyrimidine

CAS No.:
1692317-98-8
Catalog Number:
AG01DYTH
Molecular Formula:
C6H4ClF3N2O
Molecular Weight:
212.5570
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Product Description
Catalog Number:
AG01DYTH
Chemical Name:
4-chloro-6-methoxy-2-(trifluoromethyl)pyrimidine
CAS Number:
1692317-98-8
Molecular Formula:
C6H4ClF3N2O
Molecular Weight:
212.5570
MDL Number:
MFCD22397999
IUPAC Name:
4-chloro-6-methoxy-2-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C6H4ClF3N2O/c1-13-4-2-3(7)11-5(12-4)6(8,9)10/h2H,1H3
InChI Key:
LBUQLUWVXNDBGF-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)nc(n1)C(F)(F)F
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.996g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.556g/mol
Monoisotopic Mass:
211.996g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties