Basic information
- CAS
18705-01-6- Standard SMILES
O=C(COc1ccccc1)Nc1ccccc1- InChIKey
VDLGLFVMQUNFST-UHFFFAOYSA-N- Molecular formula
- C14H13NO2
- Average molar mass
- 227.26 g/mol
- Monoisotopic mass
- 227.09462866
Names & identifiers
- Preferred name
- Phenoxyacetanilide
- IUPAC
- 2-phenoxy-N-phenylacetamide
- English name
- Acetamide,2-phenoxy-N-phenyl-
- Molecular formula
- C14H13NO2
- Molecular weight
- 227.26
Names & synonyms
18705-01-6DTXSID80877479PHENOXYACETANILIDERefChem:369592DTXCID1010155562-phenoxy-N-phenylacetamideN-phenyl-2-phenoxyacetamideNSC99249NCIOpen2_006551Oprea1_445628SCHEMBL3498895SCHEMBL5461844
Show more names
Acetamide,2-phenoxy-N-phenyl-
SCHEMBL6332042SCHEMBL6341464HMS1583L10NSC-99249STK047735AKOS000346647CCG-348291ST45188468
Database identifiers
- CAS
18705-01-6- PubChem CID
- 264248
- DTXSID
DTXSID80877479- EC Number
- 137-805-2
- Nikkaji
- J1.595.698D
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 230
Experimental & physicochemical properties
LogP2.73
Physicochemical properties
- Melting point
- 99 · 99-100 °C
- Boiling point
- 444.2 · 444.2±28.0 °C(Predicted)
- Density
- 1.19 · 1.190±0.06 g/cm3(Predicted)
- pka
- 13.52 · 13.52±0.70(Predicted)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Chemistry & industry
Suppliers3 total
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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