Basic information
- CAS
114460-41-2- Standard SMILES
CCc1nc2c(ccc3ccc4ccc(O)cc4c32)[nH]1- InChIKey
NTGPGKFOILAMOT-UHFFFAOYSA-N- Molecular formula
- C17H14N2O
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.11061307
Names & identifiers
- Preferred name
- 3H-Phenanthro(3,4-d)imidazol-10-ol, 2-ethyl-
- IUPAC
- 2-ethyl-3H-naphtho[1,2-e]benzimidazol-10-ol
- English name
- 3H-Phenanthro(3,4-d)imidazol-10-ol, 2-ethyl-
- Molecular formula
- C17H14N2O
- Molecular weight
- 262.31
Names & synonyms
3H-Phenanthro(3,4-d)imidazol-10-ol, 2-ethyl-114460-41-22-Ethyl-3H-phenanthro(3,4-d)imidazol-10-ol2-ETHYL-3H-PHENANTHRO[3,4-D]IMIDAZOL-10-OLCCRIS 17632-ethyl-3H-naphtho[1,2-e]benzimidazol-10-olDTXSID701507431H-Phenanthro[4,3-d]imidazol-10-ol, 2-ethyl-
Database identifiers
- CAS
114460-41-2- PubChem CID
- 150595
- DTXSID
DTXSID70150743
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 361
Physicochemical properties
- Boiling point
- 600.4 · 600.4±28.0 °C(Predicted)
- Density
- 1.348 · 1.348±0.06 g/cm3(Predicted)
- pka
- 15.04 · 15.04±0.30(Predicted)
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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