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Home > Fluorides > 116470-66-7
116470-66-7 | Pyridine, 5-nitro-2-(trifluoromethyl)-
CAS No: 116470-66-7 Catalog No: AG000CKO MDL No:MFCD07777204
Product Description
Catalog Number:
AG000CKO
Chemical Name:
Pyridine, 5-nitro-2-(trifluoromethyl)-
CAS Number:
116470-66-7
Molecular Formula:
C6H3F3N2O2
Molecular Weight:
192.0954
MDL Number:
MFCD07777204
IUPAC Name:
5-nitro-2-(trifluoromethyl)pyridine
InChI:
InChI=1S/C6H3F3N2O2/c7-6(8,9)5-2-1-4(3-10-5)11(12)13/h1-3H
InChI Key:
ZTSJYRKGWJZNON-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(nc1)C(F)(F)F
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.015g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
192.097g/mol
Monoisotopic Mass:
192.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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