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4,4',5,5'-Tetrakis(trifluoromethyl)-2,2'-bipyridine

HCID 71344530
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Basic information

CAS
142946-81-4
Standard SMILES
FC(F)(F)c1cnc(-c2cc(C(F)(F)F)c(C(F)(F)F)cn2)cc1C(F)(F)F
InChIKey
SSONAJODJYLEBV-UHFFFAOYSA-N
Molecular formula
C14H4F12N2
Average molar mass
428.17 g/mol
Monoisotopic mass
428.0182861

Names & identifiers

Preferred name
4,4',5,5'-Tetrakis(trifluoromethyl)-2,2'-bipyridine
IUPAC
2-[4,5-bis(trifluoromethyl)-2-pyridinyl]-4,5-bis(trifluoromethyl)pyridine

Names & synonyms

4,4',5,5'-Tetrakis(trifluoromethyl)-2,2'-bipyridine142946-81-4SCHEMBL16535726DTXSID50770943SSONAJODJYLEBV-UHFFFAOYSA-N

Database identifiers

CAS
142946-81-4
PubChem CID
71344530
DTXSID
DTXSID50770943
Nikkaji
J1.376.941I

Properties

Computed structural properties

XLogP
5
Topological polar surface area
25.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
14
Rotatable bonds
1
Heavy atoms
28
Formal charge
0
Complexity
486

Related reactions

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Compound notes

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