Ethyl 4-acetylphenylacetate
Basic information
- CAS
1528-42-3- Standard SMILES
CCOC(=O)Cc1ccc(C(C)=O)cc1- InChIKey
UYKWAZSTKGYKOG-UHFFFAOYSA-N- Molecular formula
- C12H14O3
- Average molar mass
- 206.24 g/mol
- Monoisotopic mass
- 206.0942943
Names & identifiers
- Preferred name
- Ethyl 4-acetylphenylacetate
- IUPAC
- ethyl 2-(4-acetylphenyl)acetate
- English name
- ethyl 4-acetylphenylacetate
- Molecular formula
- C12H14O3
- Molecular weight
- 206.24
Names & synonyms
Ethyl 4-acetylphenylacetateEINECS 216-206-0RefChem:595282216-206-0ethyl 2-(4-acetylphenyl)acetate1528-42-3MFCD10698673ethyl (4-acetylphenyl)acetateethyl 4-acetyl-phenylacetateSCHEMBL393094DTXSID30934602ethyl 2-(4-acetylphenyl) acetate
Show more names
ethyl 2-(4-acetylphenyl)acetatEthyl 4-acet-ylphenyl-acet-ic acid4-Acetylbenzeneacetic acid ethyl ester(4-Acetylphenyl)acetic acid ethyl esterBenzeneacetic acid,4-acetyl-, ethyl ester4-acetyl-Benzeneacetic acid ethyl ester (9CI ACI)Benzeneacetic acid, 4-acetyl-, ethyl ester (9CI, ACI)
BAA52842AKOS009320779AS-78167SY022987DB-114383CS-0216299NS00045076EN300-39174
Database identifiers
- CAS
1528-42-3- PubChem CID
- 73716
- DTXSID
DTXSID30934602- EC Number
- 216-206-0
- Nikkaji
- J206.740D
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 227
Physicochemical properties
- Melting point
- 61 · 61-64 °C
- Boiling point
- 315.5 · 315.5±25.0 °C(Predicted)
- Density
- 1.083 · 1.083±0.06 g/cm3(Predicted)
- storage temp.
- Store at Room Tem.
- Appearance
- white solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
- HS Code
- 2918300090 · 2918300090
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesSkin Irrit. 2 (100%)
Safety data
- hs_code
- 2918300090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
8 records
Compound notes
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