Basic information
- CAS
104024-17-1- Standard SMILES
CC(C)(C)CC(C)(C)c1ccc(Oc2ccc([N+]#N)cc2)cc1- InChIKey
HZMSRRFMNDMBSF-UHFFFAOYSA-N- Molecular formula
- C20H25N2O+
- Average molar mass
- 309.4 g/mol
- Monoisotopic mass
- 309.19668843
Names & identifiers
- Preferred name
- 4-[4-(2,4,4-Trimethylpentan-2-yl)phenoxy]benzene-1-diazonium
- IUPAC
- 4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]benzenediazonium
Names & synonyms
104024-17-1SCHEMBL3316442DTXSID705586444-[4-(2,4,4-Trimethylpentan-2-yl)phenoxy]benzene-1-diazonium
Database identifiers
- CAS
104024-17-1- PubChem CID
- 14297828
- DTXSID
DTXSID70558644
Properties
Computed structural properties
- XLogP
- 7.5
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 1
- Complexity
- 413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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