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1448777-33-0 | 4-Pyridinecarbonitrile, 2-chloro-3-(trifluoromethyl)-
CAS No: 1448777-33-0 Catalog No: AG001K9L MDL No:
Product Description
Catalog Number:
AG001K9L
Chemical Name:
4-Pyridinecarbonitrile, 2-chloro-3-(trifluoromethyl)-
CAS Number:
1448777-33-0
Molecular Formula:
C7H2ClF3N2
Molecular Weight:
206.5524
IUPAC Name:
2-chloro-3-(trifluoromethyl)pyridine-4-carbonitrile
InChI:
InChI=1S/C7H2ClF3N2/c8-6-5(7(9,10)11)4(3-12)1-2-13-6/h1-2H
InChI Key:
HBDWJBKSPCHGKH-UHFFFAOYSA-N
SMILES:
N#Cc1ccnc(c1C(F)(F)F)Cl
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:
2.4
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