Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-ethandiyl ester
Basic information
- CAS
14496-63-0- Standard SMILES
CC(C)(Oc1ccc(Cl)cc1)C(=O)OCCOC(=O)C(C)(C)Oc1ccc(Cl)cc1- InChIKey
SOTYXLLMVQKIQB-UHFFFAOYSA-N- Molecular formula
- C22H24Cl2O6
- Average molar mass
- 455.3 g/mol
- Monoisotopic mass
- 454.0949939
Names & identifiers
- Preferred name
- Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-ethandiyl ester
- IUPAC
- 2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl 2-(4-chlorophenoxy)-2-methylpropanoate
- English name
- Ethylenebis[2-(4-chlorophenoxy)-2-methylpropionate]
- Molecular formula
- C22H24Cl2O6
- Molecular weight
- 455.33
Names & synonyms
Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, 1,2-ethandiyl esterBRN 189701514496-63-01,2-Ethanediyl bis(alpha-(p-chlorophenoxy)isobutyrate)DTXSID20162851RefChem:375171DTXCID30853422-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxyethyl 2-(4-chlorophenoxy)-2-methylpropanoateEthane-1,2-diyl bis[2-(4-chlorophenoxy)-2-methylpropanoate]Ethylenebis[2-(4-chlorophenoxy)-2-methylpropionate]Propionic acid, 2-(p-chlorophenoxy)-2-methyl-, ethylene ester (8CI)
Database identifiers
- CAS
14496-63-0- PubChem CID
- 203458
- DTXSID
DTXSID20162851- Nikkaji
- J51.078E
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 514
Physicochemical properties
- Melting point
- 26 · 26-30 °C
- Boiling point
- 205 · 205-210 °C(Press: 0.08 Torr)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
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Related reactions
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Compound notes
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