Basic information
- CAS
37592-89-5- Standard SMILES
CCCCCCCc1ccc(N=[N+]([O-])c2ccc(CCCCCCC)cc2)cc1- InChIKey
QGBNLWGTPRDGLR-UHFFFAOYSA-N- Molecular formula
- C26H38N2O
- Average molar mass
- 394.6 g/mol
- Monoisotopic mass
- 394.29841384
Names & identifiers
- Preferred name
- 4,4'-Diheptylazoxybenzene
- IUPAC
- (4-heptylphenyl)-(4-heptylphenyl)imino-oxidoazanium
- English name
- 4,4'-Diheptylazoxybenzene
- Molecular formula
- C26H38N2O
- Molecular weight
- 394.59
Names & synonyms
4,4'-Diheptylazoxybenzene37592-89-5(4-heptylphenyl)-(4-heptylphenyl)imino-oxidoazanium(4,4'-Diheptyl)azoxybenzeneSCHEMBL28234578AKOS0329535611,2-Bis(4-heptylphenyl)diazene 1-oxideST50828223amino(4-heptylphenyl)[(4-heptylphenyl)azamethylene]-1-ol4,4'-diheptylazobenzene4,4-Diheptylazoxybenzene 95%Diazene, 1,2-bis(4-heptylphenyl)-, 1-oxide
Show more names
4,4''-DIHEPTYLAZOXYBENZENE ---LOW TEMPERATURE LIQUID CRYSTAL---
Database identifiers
- CAS
37592-89-5- PubChem CID
- 142174
- Nikkaji
- J681.725D
Properties
Computed structural properties
- XLogP
- 10.2
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 14
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 420
Physicochemical properties
- Melting point
- 71.5 °C · 71.5 °C (polymorph)
- Boiling point
- 517.3 · 517.3±53.0 °C(Predicted)
- Density
- 0.97 · 0.97±0.1 g/cm3(Predicted)
- Flash point
- 230 °F · >230 °F
- form
- liquid crystal (nematic)
- WGK Germany
- 3 · 3
Safety & regulation
Safety data
- wgk
- 3
Chemistry & industry
Suppliers10 total
FRINTON[email protected]
广州伟伯科技有限公司[email protected]
Carbone Scientific CO., LTD[email protected]
PFALTZ-BAUER[email protected]
SIGMA—
MATRIX[email protected]
先进技术工业有限公司[email protected]
Service Chemical Inc.[email protected]
SIGMAALDRICH—
3B Scientific Corporation[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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