Basic information
- CAS
87319-12-8- Standard SMILES
CC1(C)OC[C@H](CC(=O)O)O1- InChIKey
OIUZBDNWEHNDHO-YFKPBYRVSA-N- Molecular formula
- C7H12O4
- Average molar mass
- 160.17 g/mol
- Monoisotopic mass
- 160.07355886
Names & identifiers
- Preferred name
- [(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]acetic acid
- IUPAC
- 2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]acetic acid
Names & synonyms
87319-12-8[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]acetic acidSCHEMBL2066105DTXSID30556444(S)-2-(2,2-DIMETHYL-1,3-DIOXOLAN-4-YL)ACETIC ACIDAKOS006315954AT21576
Database identifiers
- CAS
87319-12-8- PubChem CID
- 14141015
- DTXSID
DTXSID30556444- Nikkaji
- J1.599.240I
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 164
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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