Basic information
- CAS
136801-92-8- Standard SMILES
COC(=O)C=C1CCC(C)O1- InChIKey
OSKPHNFOIQIJSF-UHFFFAOYSA-N- Molecular formula
- C8H12O3
- Average molar mass
- 156.18 g/mol
- Monoisotopic mass
- 156.07864424
Names & identifiers
- Preferred name
- Acetic acid, (dihydro-5-methyl-2(3H)-furanylidene)-, methyl ester
- IUPAC
- methyl 2-(5-methyloxolan-2-ylidene)acetate
Names & synonyms
136801-92-8Acetic acid, (dihydro-5-methyl-2(3H)-furanylidene)-, methyl esterDTXSID10326889Methyl (5-methyloxolan-2-ylidene)acetateNCI60_006054
Database identifiers
- CAS
136801-92-8- PubChem CID
- 359526
- DTXSID
DTXSID10326889
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 184
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…