Basic information
- CAS
24643-49-0- Standard SMILES
COC(=O)CCC#CC#CCCC(=O)OC- InChIKey
LJJQOVUCWFWDOT-UHFFFAOYSA-N- Molecular formula
- C12H14O4
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.08920892
Names & identifiers
- Preferred name
- Dimethyl deca-4,6-diynedioate
- IUPAC
- dimethyl deca-4,6-diynedioate
Names & synonyms
dimethyl deca-4,6-diynedioate24643-49-0NSC156569SCHEMBL15284077DTXSID00303088LJJQOVUCWFWDOT-UHFFFAOYSA-NNSC-1565694,6-Decadiynedioic acid, dimethyl esterdeca-4:6-diynedioic acid dimethyl ester
Database identifiers
- CAS
24643-49-0- PubChem CID
- 291369
- DTXSID
DTXSID00303088
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…