2-Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl ester
Basic information
- CAS
68922-02-1- Standard SMILES
CCOC(=O)C1OC1c1ccccc1O- InChIKey
YHLXQQKBZYAGLQ-UHFFFAOYSA-N- Molecular formula
- C11H12O4
- Average molar mass
- 208.21 g/mol
- Monoisotopic mass
- 208.07355886
Names & identifiers
- Preferred name
- 2-Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl ester
- IUPAC
- ethyl 3-(2-hydroxyphenyl)oxirane-2-carboxylate
- English name
- ethyl 3-(2-hydroxyphenyl)oxirane-2-carboxylate
- Molecular formula
- C11H12O4
- Molecular weight
- 208.21
Names & synonyms
Ethyl (o-hydroxyphenyl)glycidate68922-02-1EINECS 272-975-2Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl ester2-Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl esterDTXSID40887579RefChem:88895DTXCID001026869Ethyl 3-(2-hydroxyphenyl)oxirane-2-carboxylateYHLXQQKBZYAGLQ-UHFFFAOYSA-NNS000631263-(2-Hydroxyphenyl)-2-oxiranecarboxylic acid ethyl ester
Database identifiers
- CAS
68922-02-1- PubChem CID
- 111437
- DTXSID
DTXSID40887579- EC Number
- 272-975-2
- Nikkaji
- J332.729I
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 59.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 241
Physicochemical properties
- Boiling point
- 264.4 · 264.4±35.0 °C(Predicted)
- Density
- 1.293 · 1.293±0.06 g/cm3(Predicted)
- pka
- 9.79 · 9.79±0.35(Predicted)
- EPA Substance Registry System
- 3 · Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl ester (68922-02-1)
- TSCA
- TSCA listed
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
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information2-Oxiranecarboxylic acid, 3-(2-hydroxyphenyl)-, ethyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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