Bicyclo(9.2.2)pentadeca-1(14),11(15),12-trien-5-OL
Basic information
- CAS
97498-15-2- Standard SMILES
OC1CCCCCc2ccc(cc2)CCC1- InChIKey
QYPULOGCXZHATA-UHFFFAOYSA-N- Molecular formula
- C15H22O
- Average molar mass
- 218.33 g/mol
- Monoisotopic mass
- 218.16706532
Names & identifiers
- Preferred name
- Bicyclo(9.2.2)pentadeca-1(14),11(15),12-trien-5-OL
- IUPAC
- bicyclo[9.2.2]pentadeca-1(13),11,14-trien-5-ol
Names & synonyms
Bicyclo(9.2.2)pentadeca-1(14),11(15),12-trien-5-olRefChem:56827197498-15-2653-554-6AKOS024323684
Database identifiers
- CAS
97498-15-2- PubChem CID
- 4606108
- EC Number
- 653-554-6
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 182
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
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P273, P301+P317, P330, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…