Basic information
- CAS
57681-51-3- Standard SMILES
CC(=O)OC1(C)CCC(=O)O1- InChIKey
DWCORXCRWMOSCQ-UHFFFAOYSA-N- Molecular formula
- C7H10O4
- Average molar mass
- 158.15 g/mol
- Monoisotopic mass
- 158.0579088
Names & identifiers
- Preferred name
- 2-Methyl-5-oxotetrahydro-2-furanyl acetate
- IUPAC
- (2-methyl-5-oxooxolan-2-yl) acetate
Names & synonyms
2-Methyl-5-oxotetrahydro-2-furanyl acetate57681-51-3DTXSID20337103RefChem:263560DTXCID70288191(2-methyl-5-oxooxolan-2-yl) acetate2-METHYL-5-OXOOXOLAN-2-YL ACETATE2(3H)-Furanone, 5-(acetyloxy)dihydro-5-methyl-SCHEMBL15026378DWCORXCRWMOSCQ-UHFFFAOYSA-NAKOS0159051742-Methyl-5-oxotetrahydro-2-furanyl acetate #
Database identifiers
- CAS
57681-51-3- PubChem CID
- 538656
- DTXSID
DTXSID20337103- Nikkaji
- J3.527.235F
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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