1,2-Benzenediamine, 4,5-bis(hexyloxy)-
Basic information
- CAS
86723-21-9- Standard SMILES
CCCCCCOc1cc(N)c(N)cc1OCCCCCC- InChIKey
PDCFFOMPXMEPOT-UHFFFAOYSA-N- Molecular formula
- C18H32N2O2
- Average molar mass
- 308.5 g/mol
- Monoisotopic mass
- 308.24637827
Names & identifiers
- Preferred name
- 1,2-Benzenediamine, 4,5-bis(hexyloxy)-
- IUPAC
- 4,5-dihexoxybenzene-1,2-diamine
Names & synonyms
86723-21-91,2-Benzenediamine, 4,5-bis(hexyloxy)-DTXSID80469858RefChem:215444DTXCID304206764,5-Bis(hexyloxy)benzene-1,2-diamine4,5-dihexoxybenzene-1,2-diamineSCHEMBL1979664SCHEMBL30861903
Database identifiers
- CAS
86723-21-9- PubChem CID
- 11638133
- DTXSID
DTXSID80469858- Nikkaji
- J1.864.815F
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 70.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 12
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 237
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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