2-Ethyl-1,4-naphthalenediol
Basic information
- CAS
34987-32-1- Standard SMILES
CCc1cc(O)c2ccccc2c1O- InChIKey
LYIJEYBEBVILKC-UHFFFAOYSA-N- Molecular formula
- C12H12O2
- Average molar mass
- 188.22 g/mol
- Monoisotopic mass
- 188.08372962
Names & identifiers
- Preferred name
- 2-Ethyl-1,4-naphthalenediol
- IUPAC
- 2-ethylnaphthalene-1,4-diol
Names & synonyms
2-Ethyl-1,4-naphthalenediol34987-32-12-ethylnaphthalene-1,4-diolSCHEMBL22778226SCHEMBL29525444DTXSID501310267
Database identifiers
- CAS
34987-32-1- PubChem CID
- 13077288
- DTXSID
DTXSID501310267
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 193
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…