4-Chlorophenyl (4-chlorophenoxy)acetate
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Basic information
- CAS
62095-40-3- Standard SMILES
O=C(COc1ccc(Cl)cc1)Oc1ccc(Cl)cc1- InChIKey
ZHFUIQPOLJKHGH-UHFFFAOYSA-N- Molecular formula
- C14H10Cl2O3
- Average molar mass
- 297.1 g/mol
- Monoisotopic mass
- 296.0006996
Names & identifiers
- Preferred name
- 4-Chlorophenyl (4-chlorophenoxy)acetate
- IUPAC
- (4-chlorophenyl) 2-(4-chlorophenoxy)acetate
- English name
- 4-chlorophenyl (4-chlorophenoxy)acetate
- Molecular formula
- C14H10Cl2O3
- Molecular weight
- 297.13
Names & synonyms
4-chlorophenyl (4-chlorophenoxy)acetate62095-40-3Acetic acid, (4-chlorophenoxy)-, 4-chlorophenyl ester(4-chlorophenyl) 2-(4-chlorophenoxy)acetateSCHEMBL7068289DTXSID30357271STK123875AKOS0004943644-chlorophenyl 2-(4-chlorophenoxy)acetateST45041941AO-548/11487610Acetic acid, 2-(4-chlorophenoxy)-, 4-chlorophenyl ester
Database identifiers
- CAS
62095-40-3- PubChem CID
- 849029
- DTXSID
DTXSID30357271
Properties
Computed structural propertiesFilling in
- XLogP
- 4.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 282
Physicochemical properties
- Melting point
- 118 · 118-119 °C
- Boiling point
- 427.5 · 427.5±35.0 °C(Predicted)
- Density
- 1.354 · 1.354±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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