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Home > Aldehydes > 1198016-48-6
1198016-48-6 | 3-METHYL-2-(TRIFLUOROMETHYL)PYRIDINE-5-CARBALDEHYDE
CAS No: 1198016-48-6 Catalog No: AG01E65J MDL No:
Product Description
Catalog Number:
AG01E65J
Chemical Name:
3-METHYL-2-(TRIFLUOROMETHYL)PYRIDINE-5-CARBALDEHYDE
CAS Number:
1198016-48-6
Molecular Formula:
C8H6F3NO
Molecular Weight:
189.1345
IUPAC Name:
5-methyl-6-(trifluoromethyl)pyridine-3-carbaldehyde
InChI:
InChI=1S/C8H6F3NO/c1-5-2-6(4-13)3-12-7(5)8(9,10)11/h2-4H,1H3
InChI Key:
NRWUCCZJOKXKNK-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(c(c1)C)C(F)(F)F
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.04g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.137g/mol
Monoisotopic Mass:
189.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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