9-Pentyl-phenanthrene
Basic information
- CAS
52689-26-6- Standard SMILES
CCCCCc1cc2ccccc2c2ccccc12- InChIKey
UQZRADYVCAKDRA-UHFFFAOYSA-N- Molecular formula
- C19H20
- Average molar mass
- 248.4 g/mol
- Monoisotopic mass
- 248.15650064
Names & identifiers
- Preferred name
- 9-Pentyl-phenanthrene
- IUPAC
- 9-pentylphenanthrene
- English name
- 9-Pentyl-phenanthrene
- Molecular formula
- C19H20
- Molecular weight
- 248.36
Names & synonyms
9-PENTYL-PHENANTHRENERefChem:549877620-956-89-pentylphenanthrene52689-26-6DTXSID40402867STK368379AKOS005444428DB-369775Phenanthrene, 9-pentyl-
Database identifiers
- CAS
52689-26-6- PubChem CID
- 4401431
- DTXSID
DTXSID40402867- EC Number
- 620-956-8
Properties
Computed structural properties
- XLogP
- 6.8
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 269
Physicochemical properties
- Hazard statements
- 413 · H413
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- Hazard statements
- H413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…