2-Formylphenyl acetate
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Basic information
- CAS
5663-67-2- Standard SMILES
CC(=O)Oc1ccccc1C=O- InChIKey
JWSIJFDOWHFZTK-UHFFFAOYSA-N- Molecular formula
- C9H8O3
- Average molar mass
- 164.16 g/mol
- Monoisotopic mass
- 164.04734412
Names & identifiers
- Preferred name
- 2-Formylphenyl acetate
- IUPAC
- (2-formylphenyl) acetate
- English name
- 2-(Acetyloxy)-benzaldehyde
- Molecular formula
- C9H8O3
- Molecular weight
- 164.16
Names & synonyms
2-formylphenyl acetate5663-67-2DTXSID40285112RefChem:261170DTXCID20236263811-246-0(2-formylphenyl) acetate2-acetoxybenzaldehydeMFCD005537422-(ACETYLOXY)-BENZALDEHYDENSC-40538Acetylsalicyaldehyde
Show more names
2-Formylphenylacetate,techBenzaldehyde, 2-(acetyloxy)-ACETIC ACID 2-FORMYL-PHENYL ESTERMalathion Impurity 16(Methacrifos)
acetylsalicylaldehydeNSC405382-formylphenylacetateo-Formylphenyl acetate2-acetoxy-benzaldehydeSalicylaldehyde, acetateo-(Acetyloxy)benzaldehyde2-(Acetyloxy)benzaldehyde
Database identifiers
- CAS
5663-67-2- PubChem CID
- 237228
- DTXSID
DTXSID40285112- UNII
- JZZ8H55NRU
- EC Number
- 811-246-0
- Nikkaji
- J552.416D
Properties
Computed structural propertiesFilling in
- XLogP
- 1.5
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 177
Physicochemical properties
- Melting point
- 36 · 36-37 °C
- Boiling point
- 142 °C · 142 °C(Press: 15 Torr)
- Density
- 1.183 · 1.183±0.06 g/cm3(Predicted)
- form
- liquid
- color
- Clear, pale lemon
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 271 · P271-P261-P280
- 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
H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (50%)
Safety data
- hs_code
- 2918300090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P271-P261-P280
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Related reactions
5 records
Compound notes
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