Basic information
- CAS
56820-12-3- Standard SMILES
CCOC(=O)c1c(C)oc2ccc(OC(C)=O)cc12- InChIKey
MQQLZGZIWPSUHH-UHFFFAOYSA-N- Molecular formula
- C14H14O5
- Average molar mass
- 262.26 g/mol
- Monoisotopic mass
- 262.08412354
Names & identifiers
- Preferred name
- Ethyl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylate
- IUPAC
- ethyl 5-acetyloxy-2-methyl-1-benzofuran-3-carboxylate
- English name
- ethyl 5-acetoxy-2-methylbenzofuran-3-carboxylate
- Molecular formula
- C14H14O5
- Molecular weight
- 262.25796
Names & synonyms
56820-12-3ethyl 5-(acetyloxy)-2-methyl-1-benzofuran-3-carboxylateethyl 5-acetoxy-2-methylbenzofuran-3-carboxylateethyl 5-acetyloxy-2-methyl-1-benzofuran-3-carboxylatestarbld0024095Oprea1_141093Oprea1_755434F0367-01555-Acetoxy-2-methyl-benzofuran-3-carboxylic acid ethyl esterBBL000802CCG-19613MFCD00430847
Show more names
STK279852AKOS000511269VS-00742CS-0314692ST45133174ethyl 5-acetoxy-2-methyl-benzofuran-3-carboxylateSR-01000481429SR-01000481429-1
Database identifiers
- CAS
56820-12-3- PubChem CID
- 790876
- EC Number
- 166-042-8
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 65.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 354
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
Danger
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+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%)
Chemistry & industry
Suppliers5 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
IFLAB-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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