Basic information
- CAS
2146-39-6- Standard SMILES
C=CC1CC2CCC1C2- InChIKey
PFUYSXSIHCSVJJ-UHFFFAOYSA-N- Molecular formula
- C9H14
- Average molar mass
- 122.21 g/mol
- Monoisotopic mass
- 122.10955045
Names & identifiers
- Preferred name
- 2-Ethenylbicyclo[2.2.1]heptane
- IUPAC
- 2-ethenylbicyclo[2.2.1]heptane
- English name
- 2-Vinylbicyclo[2.2.1]heptane
- Molecular formula
- C9H14
- Molecular weight
- 122.21
Names & synonyms
2146-39-62-ethenylbicyclo[2.2.1]heptaneDTXSID809440592-Ethenylbicyclo(2.2.1)heptaneRefChem:471374DTXCID001372414993-142-62-Vinylbicyclo[2.2.1]heptane2-vinylnorbornaneBicyclo[2.2.1]heptane, 2-ethenyl-norbornane, 2-vinyl-SCHEMBL466274
Show more names
SCHEMBL6243265SCHEMBL6834913SCHEMBL10410721SCHEMBL17888740SCHEMBL28394747PFUYSXSIHCSVJJ-UHFFFAOYSA-NEN300-1744823
Database identifiers
- CAS
2146-39-6- PubChem CID
- 548985
- DTXSID
DTXSID80944059- EC Number
- 993-142-6
- Nikkaji
- J125.168F
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 126
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Physicochemical properties
- Melting point
- 150.1 °C · 150.1 °C
- Boiling point
- 162.66 °C · 162.66°C (rough estimate)
- Density
- 0.89 · 0.8900 (rough estimate)
- refractive index
- 1.5 · 1.5000 (estimate)
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
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P273, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 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 CategoriesFlam. Liq. 3 (100%)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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