Basic information
- CAS
62992-61-4- Standard SMILES
CC(=O)Nc1ccc(OCCOC(=O)c2ccccc2OC(C)=O)cc1- InChIKey
PXBFSRVXEKCBFP-UHFFFAOYSA-N- Molecular formula
- C19H19NO6
- Average molar mass
- 357.4 g/mol
- Monoisotopic mass
- 357.12123733
Overview
Etersalate is a member of salicylates.
Names & identifiers
- Preferred name
- Eterilate
- IUPAC
- 2-(4-acetamidophenoxy)ethyl 2-acetyloxybenzoate
- English name
- etersalate
- Molecular formula
- C19H19NO6
- Molecular weight
- 357.36
Names & synonyms
EterilateBENZOIC ACID, 2-(ACETYLOXY)-, 2-(4-(ACETYLAMINO)PHENOXY)ETHYL ESTERRefChem:1380032-(p-acetamidophenyloxy)ethyl-o-acetoxybenzoateEtersalateEterylate62992-61-4Etersalate [INN]Etersalato2-(4-acetamidophenoxy)ethyl 2-acetyloxybenzoate2-(4-Acetamidophenoxy)ethyl 2-acetoxybenzoateEterylate; Etherylate
Show more names
2-[4-(Acetylamino)phenoxy]ethyl 2-(acetoxy)benzoate2-Acetyloxybenzoic acid 2-[4-(acetylamino)phenoxy]ethyl esterBenzoic acid, 2-(acetyloxy)-, 2-[4-(acetylamino)phenoxy]ethyl ester
EtherylateDaital653GN04T2GEterilato [Spanish]Etersalatum [Latin]Etersalato [Spanish]EtersalatumEterilato
Database identifiers
- CAS
62992-61-4- PubChem CID
- 44258
- DTXSID
DTXSID60212203- ChEMBL
CHEMBL2104226- ChEBI
CHEBI:135509- UNII
- 653GN04T2G
- EC Number
- 263-780-3
- Nikkaji
- J32.839A
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 90.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 486
Physicochemical properties
- Melting point
- 139 · 139-141°
- Boiling point
- 561.8 · 561.8±40.0 °C(Predicted)
- Density
- 1.263 · 1.263±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- solubility
- Soluble in DMSO
- pka
- 14.49 · 14.49±0.70(Predicted)
- FDA UNII
- 653 GN04T2G · 653GN04T2G
- Toxicity
- 10 orally · LD10 orally in rats: 7000 mg/kg (Leterier, Grafulia, 1977)
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
- Toxicity
- LD10 orally in rats: 7000 mg/kg (Leterier, Grafulia, 1977)
Chemistry & industry
Applications
UsesEtersalate inhibits platelet function and decreases thromboxane A2 (TXA2) levels.
Suppliers7 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
济南九黎生物科技有限公司15865264761 · [email protected]
Additional notes
DefinitionChEBI: Etersalate is a member of salicylates.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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