2-Methylpropylene diacetate
Basic information
- CAS
22007-58-5- Standard SMILES
CC(=O)OCC(C)(C)OC(C)=O- InChIKey
YXNVQGOUNCUZKH-UHFFFAOYSA-N- Molecular formula
- C8H14O4
- Average molar mass
- 174.19 g/mol
- Monoisotopic mass
- 174.08920892
Names & identifiers
- Preferred name
- 2-Methylpropylene diacetate
- IUPAC
- (2-acetyloxy-2-methylpropyl) acetate
- English name
- 2-methylpropylene diacetate
- Molecular formula
- C8H14O4
- Molecular weight
- 174.19
Names & synonyms
2-Methylpropylene diacetate2-methylpropane-1,2-diyl diacetate22007-58-5NNP2388RMXSCHEMBL13548866DTXSID50176446YXNVQGOUNCUZKH-UHFFFAOYSA-NEINECS 244-716-31,2-Propanediol, 2-methyl-, diacetateNS000270221,2-Propanediol, 2-methyl-, 1,2-diacetate2-Methyl-1,2-propanediol diacetate
Database identifiers
- CAS
22007-58-5- PubChem CID
- 89146
- DTXSID
DTXSID50176446- UNII
- NNP2388RMX
- EC Number
- 244-716-3
- Nikkaji
- J225.513H
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 183
Physicochemical properties
- Boiling point
- 203.9 · 203.9±13.0 °C(Predicted)
- Density
- 1.039 · 1.039±0.06 g/cm3(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…