Basic information
- CAS
854892-34-5- Standard SMILES
O=C(c1ccc(Cl)c(Cl)c1)C1CCCCC1- InChIKey
ZNFNRUZLPOEANF-UHFFFAOYSA-N- Molecular formula
- C13H14Cl2O
- Average molar mass
- 257.15 g/mol
- Monoisotopic mass
- 256.0421705
Names & identifiers
- Preferred name
- Cyclohexyl 3,4-dichlorophenyl ketone
- IUPAC
- cyclohexyl-(3,4-dichlorophenyl)methanone
- English name
- Cyclohexyl 3,4-dichlorophenyl ketone
- Molecular formula
- C13H14Cl2O
- Molecular weight
- 257.16
Names & synonyms
CYCLOHEXYL 3,4-DICHLOROPHENYL KETONE854892-34-5Cyclohexyl-(3,4-dichlorophenyl)methanoneMFCD03841375Cyclohexyl(3,4-dichlorophenyl)methanoneCYCLOHEXYL3,4-DICHLOROPHENYLKETONEDTXSID004692793,4-Dichlorophenyl cyclohexyl ketoneAKOS009377326DB-220293F204194OTAVA-BB 1044144
Show more names
Methanone, cyclohexyl(3,4-dichlorophenyl)-
Database identifiers
- CAS
854892-34-5- PubChem CID
- 11601310
- DTXSID
DTXSID00469279
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 248
Physicochemical properties
- Boiling point
- 378.3 · 378.3±27.0 °C(Predicted)
- Density
- 1.24 · 1.240±0.06 g/cm3(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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