Basic information
- CAS
2090-14-4- Standard SMILES
C1CCC2C(C1)CCC1C3CCCCC3CCC21- InChIKey
ZEMKTMFBYLHVNN-UHFFFAOYSA-N- Molecular formula
- C18H30
- Average molar mass
- 246.4 g/mol
- Monoisotopic mass
- 246.23475096
Names & identifiers
- Preferred name
- Chrysene, octadecahydro-
- IUPAC
- 1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12,12a-octadecahydrochrysene
- English name
- 1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12,12a-octadecahydrochrysene
- Molecular formula
- C18H30
- Molecular weight
- 246.43
Names & synonyms
PerhydrochryseneChrysene, octadecahydro-DTXSID90870936NSC 136862RefChem:125962DTXCID30818615ZEMKTMFBYLHVNN-UHFFFAOYSA-NChrysitaneOctadecahydrochrysene2090-14-4D-Homo-18-norestrane1,2,3,4,4a,4b,5,6,6a,7,8,9,10,10a,10b,11,12,12a-octadecahydrochrysene
Show more names
NSC136862CHRYSENE OCTAHYDROSCHEMBL1397206SCHEMBL1760687SCHEMBL8922105NSC-136862
Database identifiers
- CAS
2090-14-4- PubChem CID
- 98460
- DTXSID
DTXSID90870936- Nikkaji
- J114.118J
Properties
Computed structural properties
- XLogP
- 7.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 264
Physicochemical properties
- Melting point
- 115 ℃ · 115℃
- Boiling point
- 324.44 °C · 324.44°C (rough estimate)
- Density
- 0.8196 · 0.8196 (estimate)
- refractive index
- 1.5314 · 1.5314 (589.3 nm 25℃)
- EPA Substance Registry System
- Chrysene, octadecahydro- (2090-14-4)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationChrysene, octadecahydro-: INACTIVE
Suppliers2 total
Shaanxi Didu New Materials Co. Ltd+86-86-17392712779 +86-13289823923 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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