Allyl 3-(acetoxy)but-3-enoate
Completing data — refresh the page later to see the latest
Basic information
- CAS
85455-69-2- Standard SMILES
C=CCOC(=O)CC(=C)OC(C)=O- InChIKey
SXFHHVGLBFBLIG-UHFFFAOYSA-N- Molecular formula
- C9H12O4
- Average molar mass
- 184.19 g/mol
- Monoisotopic mass
- 184.07355886
Overview
See also: 3-Butenoic acid, 3-(acetyloxy)-, 2-propenyl ester (annotation moved to).
Names & identifiers
- Preferred name
- Allyl 3-(acetoxy)but-3-enoate
- IUPAC
- prop-2-enyl 3-acetyloxybut-3-enoate
- English name
- allyl 3-(acetoxy)but-3-enoate
- Molecular formula
- C9H12O4
- Molecular weight
- 184.18918
Names & synonyms
Allyl 3-(acetoxy)but-3-enoateEINECS 287-303-385455-69-2PROP-2-EN-1-YL 3-(ACETYLOXY)BUT-3-ENOATEDTXSID30234679SXFHHVGLBFBLIG-UHFFFAOYSA-NNS000389523-(Acetyloxy)-3-butenoic acid 2-propenyl ester
Database identifiers
- CAS
85455-69-2- PubChem CID
- 3020752
- DTXSID
DTXSID30234679- EC Number
- 287-303-3
- Nikkaji
- J333.203I
Properties
Computed structural propertiesFilling in
- XLogP
- 1
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 230
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…