Methyl 3-(2-pentyl-1,3-dioxolan-2-yl)prop-2-enoate
Basic information
- CAS
112329-11-0- Standard SMILES
CCCCCC1(C=CC(=O)OC)OCCO1- InChIKey
FAVJPLBQJLIPEU-UHFFFAOYSA-N- Molecular formula
- C12H20O4
- Average molar mass
- 228.28 g/mol
- Monoisotopic mass
- 228.13615911
Names & identifiers
- Preferred name
- Methyl 3-(2-pentyl-1,3-dioxolan-2-yl)prop-2-enoate
- IUPAC
- methyl 3-(2-pentyl-1,3-dioxolan-2-yl)prop-2-enoate
Names & synonyms
112329-11-0methyl 3-(2-pentyl-1,3-dioxolan-2-yl)prop-2-enoateDTXSID70764167
Database identifiers
- CAS
112329-11-0- PubChem CID
- 71336331
- DTXSID
DTXSID70764167
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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