Basic information
- CAS
14548-91-5- Standard SMILES
CCCC1OC(=O)C(C)O1- InChIKey
MXCIUVDKEKOBPA-UHFFFAOYSA-N- Molecular formula
- C7H12O3
- Average molar mass
- 144.17 g/mol
- Monoisotopic mass
- 144.07864424
Names & identifiers
- Preferred name
- 5-Methyl-2-propyl-1,3-dioxolan-4-one
- IUPAC
- 5-methyl-2-propyl-1,3-dioxolan-4-one
- English name
- 1,3-Dioxolan-4-one,5-methyl-2-propyl-
- Molecular formula
- C7H12O3
- Molecular weight
- 144.16838
Names & synonyms
5-methyl-2-propyl-1,3-dioxolan-4-one14548-91-5DTXSID50304621RefChem:304089DTXCID80255753NSC166510SCHEMBL27770462AKOS024332669NSC-1665101,3-Dioxolan-4-one,5-methyl-2-propyl-
Database identifiers
- CAS
14548-91-5- PubChem CID
- 296386
- DTXSID
DTXSID50304621
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 133
Chemistry & industry
Suppliers1 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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