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Home Fluorides 1017464-05-9
1017464-05-9,MFCD09881360
Catalog No.:AA0005AY
1017464-05-9 | 4-Methyl-2-(trifluoromethyl)pyrimidine
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$405.00   $283.00
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Technical Information
Catalog Number:
AA0005AY
Chemical Name:
4-Methyl-2-(trifluoromethyl)pyrimidine
CAS Number:
1017464-05-9
Molecular Formula:
C6H5F3N2
Molecular Weight:
162.1125
MDL Number:
MFCD09881360
IUPAC Name:
4-methyl-2-(trifluoromethyl)pyrimidine
InChI:
InChI=1S/C6H5F3N2/c1-4-2-3-10-5(11-4)6(7,8)9/h2-3H,1H3
InChI Key:
JHOQVQSTUMAGNQ-UHFFFAOYSA-N
SMILES:
FC(c1nccc(n1)C)(F)F
Properties
Computed Properties
 
Complexity:
134  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.04g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
162.115g/mol
Monoisotopic Mass:
162.04g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  

Synonyms
 
4-methyl-2-(trifluoromethyl)pyrimidine 
1017464-05-9 
DS-3005 
AJ-60188 
AX8221703 
ST24043887 
T191944 
AK139650 
SCHEMBL2632680 
DTXSID50610239 
FCH875499 
MFCD09881360 
ZINC11804113 
AKOS006311427 
ACN-000514 
Literature
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