Basic information
- CAS
82045-66-7- Standard SMILES
CC1(C)C(C=C(Cl)Cl)C1C(=O)OCC(O)CO- InChIKey
ZOVHKBNLHLVUMF-UHFFFAOYSA-N- Molecular formula
- C11H16Cl2O4
- Average molar mass
- 283.14 g/mol
- Monoisotopic mass
- 282.0425644
Names & identifiers
- Preferred name
- 2,3-Dihydroxypropyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
- IUPAC
- 2,3-dihydroxypropyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
Names & synonyms
82045-66-72,3-Dihydroxypropyl 3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylateDTXSID3010024142,3-Dihydroxypropyl 3-(2,2-dichloroethen-1-yl)-2,2-dimethylcyclopropane-1-carboxylate
Database identifiers
- CAS
82045-66-7- PubChem CID
- 186243
- DTXSID
DTXSID301002414
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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