Basic information
- CAS
960-92-9- Standard SMILES
Oc1cc2cc3ccccc3cc2c2ccccc12- InChIKey
VHASKISXNNMXRM-UHFFFAOYSA-N- Molecular formula
- C18H12O
- Average molar mass
- 244.3 g/mol
- Monoisotopic mass
- 244.088815
Names & identifiers
- Preferred name
- Benz[a]anthracen-5-ol
- IUPAC
- benzo[a]anthracen-5-ol
- English name
- 5-Hydroxybenzo[a]anthracene
- Molecular formula
- C18H12O
- Molecular weight
- 0
Names & synonyms
5-Hydroxybenz(a)anthraceneBenz(a)anthracen-5-olBenz[a]anthracen-5-ol3-Hydroxy-1,2-benzanthraceneCCRIS 1069NSC 30996BRN 24566800LNL93U7V1NSC-309965-Hydroxybenz[a]anthraceneUNII-0LNL93U7V1DTXSID50242079
Show more names
5-hydroxybenzanthracene5-Hydroxybenzo[a]anthracene
3-06-00-03726 (Beilstein Handbook Reference)HYDROXYBENZ(A)ANTHRACENE, 5-RefChem:117054DTXCID00164570960-92-9tetraphen-5-ol5-hydroxytetrapheneNSC30996
Database identifiers
- CAS
960-92-9- PubChem CID
- 70401
- DTXSID
DTXSID50242079- UNII
- 0LNL93U7V1
- Nikkaji
- J35.581J
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 326
Physicochemical properties
- Melting point
- 203 °C · 203°C (rough estimate)
- Boiling point
- 347.21 °C · 347.21°C (rough estimate)
- Density
- 1.0786 · 1.0786 (rough estimate)
- refractive index
- 1.47 · 1.4700 (estimate)
- color
- Golden crystals from toluene
- FDA UNII
- 0 LNL93U7V1 · 0LNL93U7V1
- Toxicity
- 5 mg/L · dnd-ham:kdy 5 mg/L BCPCA6 20,1297,71
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- dnd-ham:kdy 5 mg/L BCPCA6 20,1297,71
Chemistry & industry
Suppliers3 total
郑州汇聚化工有限公司0371-53399770 18037166334 · [email protected]
卓萃新材料科技（上海）有限公司021-52836897 13917661608 · [email protected]
上海昂卓新材料科技有限公司13918481594 13918481594 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…