Basic information
- CAS
67059-01-2- Standard SMILES
O=C1C(CCl)(CCl)CCC1(CCl)CCl- InChIKey
OPNWCHGGNNYGDZ-UHFFFAOYSA-N- Molecular formula
- C9H12Cl4O
- Average molar mass
- 278 g/mol
- Monoisotopic mass
- 275.964226
Names & identifiers
- Preferred name
- 2,2,5,5-Tetrakis(chloromethyl)cyclopentanone
- IUPAC
- 2,2,5,5-tetrakis(chloromethyl)cyclopentan-1-one
- English name
- 2,2,5,5-Tetrakis(chloromethyl)cyclopentanone
- Molecular formula
- C9H12Cl4O
- Molecular weight
- 278
Names & synonyms
2,2,5,5-Tetrakis(chloromethyl)cyclopentanone67059-01-22,2,5,5-tetrakis(chloromethyl)cyclopentan-1-oneMFCD018619132,2,5,5-Tetrakis(chloromethyl) cyclopentanoneNSC359385C9H12Cl4ODTXSID40320436GEO-02261AKOS005258401GS-0666NSC-359385
Show more names
Tetrakis(chloromethyl)cyclopentanone2,2,5,5-TETRAKIS-CHLOROMETHYL-CYCLO PENTCyclopentanone, 2,2,5,5-tetrakis(chloromethyl)-
2,2,5,5-Tetrakis(chloromethyl)cyclopentanone, 97%
Database identifiers
- CAS
67059-01-2- PubChem CID
- 338149
- DTXSID
DTXSID40320436
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 199
Physicochemical properties
- Melting point
- 71.5 · 71.5-74.5 °C(lit.)
- Boiling point
- 383.3 · 383.3±7.0 °C(Predicted)
- Density
- 1.312 · 1.312±0.06 g/cm3(Predicted)
- Hazard Codes
- C
- Risk Statements
- 34 · 34
- Safety Statements
- 45 · 45-36/37/39-26
- WGK Germany
- 3 · 3
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
- wgk
- 3
- risk_code
- 34
- hazard_code
- C
- safety_code
- 45-36/37/39-26
Chemistry & industry
Suppliers3 total
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
天津安浩生物科技有限公司[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…