Norborn-5-en-2-yl phenyl ketone
Basic information
- CAS
6056-35-5- Standard SMILES
O=C(c1ccccc1)C1CC2C=CC1C2- InChIKey
RMHYEJKELLBHSV-UHFFFAOYSA-N- Molecular formula
- C14H14O
- Average molar mass
- 198.26 g/mol
- Monoisotopic mass
- 198.10446507
Names & identifiers
- Preferred name
- Norborn-5-en-2-yl phenyl ketone
- IUPAC
- 2-bicyclo[2.2.1]hept-5-enyl(phenyl)methanone
- English name
- 2-BENZOYL-5-NORBORNENE
- Molecular formula
- C14H14O
- Molecular weight
- 198.26
Names & synonyms
6056-35-5Norborn-5-en-2-yl phenyl ketonebicyclo[2.2.1]hept-5-en-2-yl(phenyl)methanone2-Benzoyl-5-norbornene2-bicyclo[2.2.1]hept-5-enyl(phenyl)methanone{BICYCLO[2.2.1]HEPT-5-EN-2-YL}(PHENYL)METHANONE(Bicyclo[2.2.1]hept-5-en-2-yl)(phenyl)methanoneEINECS 227-983-0SCHEMBL8182045-Norbornen-2-yl phenyl ketoneDTXSID00975986AKOS015912925
Show more names
Mixtureofendoandexo]2-Phenyl-5-norbornene5-NORBORNENE-2-BENZOYL2-Benzoylnorborna-5-eneBicyclo[2.2.1]hept-5-en-2-ylphenyl ketonePhenyl(bicyclo[2.2.1]hepta-5-ene-2-yl) ketone
AC-48572-Benzoyl-5-norbornene, exo(.+/-.)2-Benzoyl-5-norbornene, endo(.+/-.)NS00044965ST50406187bicyclo[2.2.1]hept-5-en-2-yl phenyl ketoneMethanone, bicyclo[2.2.1]hept-5-en-2-ylphenyl-
Database identifiers
- CAS
6056-35-5- PubChem CID
- 110758
- DTXSID
DTXSID00975986- EC Number
- 227-983-0
- Nikkaji
- J227.271G
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 286
Physicochemical properties
- Boiling point
- 122 · 122-124 °C2 mm Hg(lit.)
- Density
- 1.115 g/mL · 1.115 g/mL at 25 °C(lit.)
- refractive index
- 20 · n20/D 1.568(lit.)
- Flash point
- 230 °F · >230 °F
- InChI
- 1S/C14H14O/c15-14(11-4-2-1-3-5-11)13-9-10-6-7-12(13)8-10/h1-7,10,12-13H,8-9H2/t10-,12+,13/m1/s1
- InChIKey
- RMHYEJKELLBHSV-FVBASEICSA-N
- SMILES
- O=C(C1C[C@H]2C[C@@H]1C=C2)c3ccccc3
- CAS DataBase Reference
- 6056 · 6056-35-5
- UNSPSC Code
- 12352100 · 12352100
- NACRES
- 22 · NA.22
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P302+P352-P304+P340-P305+P351+P338
- PPE
- Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
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
- PPE
- Eyeshields, Gloves, multi-purpose combination respirator cartridge (US)
- wgk
- 3
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 24/25
- Storage Class
- 10 - Combustible liquids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Applications
UsesNorbornenes comprise of compounds with norbornene ring moiety, and also include norbornadiene, substituted norbornenes and polycyclic norbornenes. The substituted norbornenes possess a norbornene ring moiety and at least one substituent group.
General DescriptionNorbornenes comprise of compounds with norbornene ring moiety, and also include norbornadiene, substituted norbornenes and polycyclic norbornenes. The substituted norbornenes possess a norbornene ring moiety and at least one substituent group.
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…