Pyrimidine, 5-hexyl-2-(4'-pentyl[1,1'-biphenyl]-4-yl)-
Basic information
- CAS
92178-46-6- Standard SMILES
CCCCCCc1cnc(-c2ccc(-c3ccc(CCCCC)cc3)cc2)nc1- InChIKey
JLBMALJTULZYEO-UHFFFAOYSA-N- Molecular formula
- C27H34N2
- Average molar mass
- 386.6 g/mol
- Monoisotopic mass
- 386.27219909
Names & identifiers
- Preferred name
- Pyrimidine, 5-hexyl-2-(4'-pentyl[1,1'-biphenyl]-4-yl)-
- IUPAC
- 5-hexyl-2-[4-(4-pentylphenyl)phenyl]pyrimidine
Names & synonyms
92178-46-65-Hexyl-2-(4'-pentyl-[1,1'-biphenyl]-4-yl)pyrimidinePyrimidine, 5-hexyl-2-(4'-pentyl[1,1'-biphenyl]-4-yl)-ZINC29213105-HEXYL-2-{4'-PENTYL-[1,1'-BIPHENYL]-4-YL}PYRIMIDINE5-hexyl-2-[4-(4-pentylphenyl)phenyl]pyrimidineZINC02921310SCHEMBL9222757DTXSID20348097JLBMALJTULZYEO-UHFFFAOYSA-NMFCD00627646STK012584
Show more names
AKOS005376962ZINC0000029213105HEXYL2(4PENTYLBIPHENYL4YL)PYRIMIDINE5-hexyl-2-(4'-pentyl-4-biphenylyl)pyrimidine5-hexyl-2-(4'-pentylbiphenyl-4-yl)pyrimidineCCCCCCc1cnc(nc1)c1ccc(cc1)c1ccc(cc1)CCCCCG863255HEXYL2(4(4PENTYLPHENYL)PHENYL)PYRIMIDINE
Database identifiers
- CAS
92178-46-6- PubChem CID
- 630190
- DTXSID
DTXSID20348097- Nikkaji
- J3.576.993E
Properties
Computed structural properties
- XLogP
- 8.9
- Topological polar surface area
- 25.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 399
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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