Phenyl (4-chlorophenoxy)acetate
Basic information
- CAS
62095-51-6- Standard SMILES
O=C(COc1ccc(Cl)cc1)Oc1ccccc1- InChIKey
NUNLXXARLCXOPW-UHFFFAOYSA-N- Molecular formula
- C14H11ClO3
- Average molar mass
- 262.69 g/mol
- Monoisotopic mass
- 262.0396719
Names & identifiers
- Preferred name
- Phenyl (4-chlorophenoxy)acetate
- IUPAC
- phenyl 2-(4-chlorophenoxy)acetate
- English name
- phenyl (4-chlorophenoxy)acetate
- Molecular formula
- C14H11ClO3
- Molecular weight
- 262.69
Names & synonyms
phenyl 2-(4-chlorophenoxy)acetate62095-51-6phenyl (4-chlorophenoxy)acetateAcetic acid, (4-chlorophenoxy)-, phenyl esterTimTec1_002916Oprea1_050364Oprea1_822777DTXSID70352604HMS1542E12STK018809AKOS000491962ST039974
Show more names
Acetic acid, 2-(4-chlorophenoxy)-, phenyl ester
AN-329/40887288
Database identifiers
- CAS
62095-51-6- PubChem CID
- 730139
- DTXSID
DTXSID70352604
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 256
Physicochemical properties
- Boiling point
- 398.3 · 398.3±22.0 °C(Predicted)
- Density
- 1.266 · 1.266±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
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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