Basic information
- CAS
925238-70-6- Standard SMILES
CCCCOc1ccc(N=Nc2ccc(OCCCCCCBr)cc2)cc1- InChIKey
KKTIBMWUJCDKGL-UHFFFAOYSA-N- Molecular formula
- C22H29BrN2O2
- Average molar mass
- 433.4 g/mol
- Monoisotopic mass
- 432.14124
Names & identifiers
- Preferred name
- (E)-1-{4-[(6-Bromohexyl)oxy]phenyl}-2-(4-butoxyphenyl)diazene
- IUPAC
- [4-(6-bromohexoxy)phenyl]-(4-butoxyphenyl)diazene
Names & synonyms
925238-70-6DTXSID60854001(E)-1-{4-[(6-Bromohexyl)oxy]phenyl}-2-(4-butoxyphenyl)diazene
Database identifiers
- CAS
925238-70-6- PubChem CID
- 71445461
- DTXSID
DTXSID60854001
Properties
Computed structural properties
- XLogP
- 7.1
- Topological polar surface area
- 43.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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