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1196155-38-0 | 4-Pyridinecarbonitrile, 2-chloro-6-(trifluoromethyl)-
CAS No: 1196155-38-0 Catalog No: AG000PBU MDL No:MFCD13190042
Product Description
Catalog Number:
AG000PBU
Chemical Name:
4-Pyridinecarbonitrile, 2-chloro-6-(trifluoromethyl)-
CAS Number:
1196155-38-0
Molecular Formula:
C7H2ClF3N2
Molecular Weight:
206.5524
MDL Number:
MFCD13190042
IUPAC Name:
2-chloro-6-(trifluoromethyl)pyridine-4-carbonitrile
InChI:
InChI=1S/C7H2ClF3N2/c8-6-2-4(3-12)1-5(13-6)7(9,10)11/h1-2H
InChI Key:
DKJFUZIDAHUIJV-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Cl)nc(c1)C(F)(F)F
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.552g/mol
Monoisotopic Mass:
205.986g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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