2-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (Z)-
Basic information
- CAS
61203-77-8- Standard SMILES
COC(=O)C=CC(C)(OC)OC- InChIKey
ITHKHLNISGKTBY-UHFFFAOYSA-N- Molecular formula
- C8H14O4
- Average molar mass
- 174.19 g/mol
- Monoisotopic mass
- 174.08920892
Names & identifiers
- Preferred name
- 2-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (Z)-
- IUPAC
- methyl 4,4-dimethoxypent-2-enoate
- English name
- (Z)-4,4-Dimethoxy-2-pentenoic acid methyl ester
- Molecular formula
- C8H14O4
- Molecular weight
- 174.19
Names & synonyms
61203-77-82-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (Z)-methyl 4,4-dimethoxypent-2-enoateDTXSID00343282(Z)-4,4-Dimethoxy-2-pentenoic acid methyl ester2-Pentenoic acid, 4,4-dimethoxy-, methyl ester, (Z)- (9CI)
Database identifiers
- CAS
61203-77-8- PubChem CID
- 588703
- DTXSID
DTXSID00343282
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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