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Home > Aldehydes > 1260783-89-8
1260783-89-8 | 5-Pyrimidinecarboxaldehyde, 2-methyl-4-(trifluoromethyl)-
CAS No: 1260783-89-8 Catalog No: AG000R8T MDL No:
Product Description
Catalog Number:
AG000R8T
Chemical Name:
5-Pyrimidinecarboxaldehyde, 2-methyl-4-(trifluoromethyl)-
CAS Number:
1260783-89-8
Molecular Formula:
C7H5F3N2O
Molecular Weight:
190.1226
IUPAC Name:
2-methyl-4-(trifluoromethyl)pyrimidine-5-carbaldehyde
InChI:
InChI=1S/C7H5F3N2O/c1-4-11-2-5(3-13)6(12-4)7(8,9)10/h2-3H,1H3
InChI Key:
JSQBZKCRWRCOOJ-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(nc1C(F)(F)F)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.035g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
190.125g/mol
Monoisotopic Mass:
190.035g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
42.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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