Basic information
- CAS
3277-78-9- Standard SMILES
Cc1cccc(C(=O)C2CCCCC2)c1- InChIKey
QGCLTCPKWGVNFG-UHFFFAOYSA-N- Molecular formula
- C14H18O
- Average molar mass
- 202.29 g/mol
- Monoisotopic mass
- 202.13576519
Names & identifiers
- Preferred name
- Cyclohexyl m-tolyl ketone
- IUPAC
- cyclohexyl-(3-methylphenyl)methanone
- English name
- cyclohexyl m-tolyl ketone
- Molecular formula
- C14H18O
- Molecular weight
- 202.29
Names & synonyms
Cyclohexyl m-tolyl ketone3277-78-9CYCLOHEXYL 3-METHYLPHENYL KETONEcyclohexyl-(3-methylphenyl)methanonecyclohexyl(m-tolyl)methanoneMFCD03841338cyclohexyl(3-methylphenyl)methanoneEINECS 221-908-53-Methylphenyl cyclohexyl ketoneSCHEMBL10025158DTXSID40186433QGCLTCPKWGVNFG-UHFFFAOYSA-N
Show more names
3-Methylphenylcyclohexyl ketoneMethanone, cyclohexyl(3-methylphenyl)-
AR-1G0320AKOS010015355NS00029340H72070F204154
Database identifiers
- CAS
3277-78-9- PubChem CID
- 76763
- DTXSID
DTXSID40186433- EC Number
- 221-908-5
- Nikkaji
- J262.378A
Properties
Computed structural properties
- XLogP
- 4.1
- 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
- 215
Physicochemical properties
- Boiling point
- 100 °C · 100 °C(Press: 0.015 Torr)
- Density
- 1.012 · 1.012±0.06 g/cm3(Predicted)
Chemistry & industry
Suppliers6 total
天津福瑞凯科技有限公司15602163079 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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