Basic information
- CAS
54843-13-9- Standard SMILES
CCOC(=O)C(C)=CO- InChIKey
UPWSFLJBKRQKBD-UHFFFAOYSA-N- Molecular formula
- C6H10O3
- Average molar mass
- 130.14 g/mol
- Monoisotopic mass
- 130.06299418
Names & identifiers
- Preferred name
- Ethyl 3-hydroxy-2-methylprop-2-enoate
- IUPAC
- ethyl 3-hydroxy-2-methylprop-2-enoate
Names & synonyms
2-Propenoic acid, 3-hydroxy-2-methyl-, ethyl esterethyl 3-hydroxy-2-methylprop-2-enoate54843-13-9ethyl 3-hydroxy-2-methyl-2-propenoateSCHEMBL79140DTXSID40334679UPWSFLJBKRQKBD-UHFFFAOYSA-N
Database identifiers
- CAS
54843-13-9- PubChem CID
- 521546
- DTXSID
DTXSID40334679
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 126
Related reactions
3 records
Compound notes
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