Basic information
- CAS
7258-52-8- Standard SMILES
c1ccc2c(c1)ccc1ccc3c(c12)CCC3- InChIKey
NVXCSOMVRCVFHF-UHFFFAOYSA-N- Molecular formula
- C17H14
- Average molar mass
- 218.29 g/mol
- Monoisotopic mass
- 218.10955045
Names & identifiers
- Preferred name
- 1H-Cyclopenta(c)phenanthrene, 2,3-dihydro-
- IUPAC
- 2,3-dihydro-1H-cyclopenta[c]phenanthrene
- English name
- 1H-Cyclopenta(c)phenanthrene, 2,3-dihydro-
- Molecular formula
- C17H14
- Molecular weight
- 218.29
Names & synonyms
CCRIS 80121H-Cyclopenta(c)phenanthrene, 2,3-dihydro-2,3-dihydro-1H-cyclopenta[c]phenanthrene7258-52-82,3-Dihydro-1H-cyclopenta(c)phenanthrene1(H)-2,3-Dihydrocyclopenta(c)phenanthreneDTXSID40222901RefChem:237761DTXCID30145392
Database identifiers
- CAS
7258-52-8- PubChem CID
- 146019
- DTXSID
DTXSID40222901- Nikkaji
- J762.313E
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Boiling point
- 146 °C · 146°C
- Density
- 1.171 · 1.1710 (estimate)
- refractive index
- 1.6765 · 1.6765 (estimate)
- 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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