Allyl 2-methylbutyrate
Completing data — refresh the page later to see the latest
Basic information
- CAS
93963-13-4- Standard SMILES
C=CCOC(=O)C(C)CC- InChIKey
ZSPLJXGRHFJQKO-UHFFFAOYSA-N- Molecular formula
- C8H14O2
- Average molar mass
- 142.2 g/mol
- Monoisotopic mass
- 142.09937969
Names & identifiers
- Preferred name
- Allyl 2-methylbutyrate
- IUPAC
- prop-2-enyl 2-methylbutanoate
- English name
- allyl 2-methylbutyrate
- Molecular formula
- C8H14O2
- Molecular weight
- 142.19556
Names & synonyms
Allyl 2-methylbutyrate93963-13-4EINECS 300-753-8PROP-2-EN-1-YL 2-METHYLBUTANOATESCHEMBL9283778DTXSID60916875ZSPLJXGRHFJQKO-UHFFFAOYSA-NNS000637202-Methylbutanoic acid 2-propenyl ester
Database identifiers
- CAS
93963-13-4- PubChem CID
- 3023083
- DTXSID
DTXSID60916875- EC Number
- 300-753-8
- Nikkaji
- J349.544B
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 118
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…