Basic information
- CAS
10138-34-8- Standard SMILES
CCCCOC(=O)C1OC1C- InChIKey
JMYWLBRCOSLRIH-UHFFFAOYSA-N- Molecular formula
- C8H14O3
- Average molar mass
- 158.19 g/mol
- Monoisotopic mass
- 158.0942943
Names & identifiers
- Preferred name
- 2,3-Epoxbutyl 2,3-epoxybutyrate
- IUPAC
- butyl 3-methyloxirane-2-carboxylate
Names & synonyms
Butyric acid, 2,3-epoxy-, butyl ester2,3-Epoxbutyl 2,3-epoxybutyrate6J8O32Z8PM10138-34-8RefChem:10595032,3-Epoxybutyric acid, butyl esterbutyl 3-methyloxirane-2-carboxylateBRN 49707472,3-Epoxybutyric acid butyl esterOxiranecarboxylic acid, 3-methyl-, butyl esterUNII-6J8O32Z8PMSCHEMBL9566682
Show more names
DTXSID00906098Q272649942-OXIRANECARBOXYLIC ACID, 3-METHYL-, BUTYL ESTER
Database identifiers
- CAS
10138-34-8- PubChem CID
- 24987
- DTXSID
DTXSID00906098- UNII
- 6J8O32Z8PM
- Nikkaji
- J35.104K
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 144
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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