1,2-Propyleneglycol diacetate

• CAS: 623-84-7
• Catalog Number: ACM623847
• Category: Biomaterials
• Molecular Weight: 160.17g/mol
• Molecular Formula: C7H12O4;OC(CH3)OCH2CH(CH3)OC(CH3)O;C7H12O4
• Description: Liquid;COLOURLESS LIQUID.;Colourless liquid; Very mild fruity acetic aroma
• Synonyms: 1,2-PROPYLENE GLYCOL DIACETATE;1,2-PROPANEDIOL DIACETATE;1,2-DIACETOXYPROPANE;DOWANOL (TM) PGDA;TIMTEC-BB SBB008331;PROPYLENE DIACETATE;PROPYLENE GLYCOL DIACETATE;PGDA
• IUPAC Name: 2-acetyloxypropyl acetate
• Canonical SMILES: CC(COC(=O)C)OC(=O)C
• InChI: InChI=1S/C7H12O4/c1-5(11-7(3)9)4-10-6(2)8/h5H,4H2,1-3H3
• InChI Key: MLHOXUWWKVQEJB-UHFFFAOYSA-N
• Boiling Point: 190.5 °C;190 °C AT 762 MM HG;190 °C
• Melting Point: -31 °C
• Flash Point: 86 °C
• Density: 1.059 AT 20 °C/4 °C;Relative density (water = 1): 1.06;1.055-1.060 (20?°)
• Solubility: 0.62 M;VERY SOL IN WATER; SOL IN ETHYL ALCOHOL, ETHYL ETHER;Solubility in water, g/100ml: 10 (good);Very slightly soluble in water;Soluble (in ethanol)
• Autoignition Temperature: 431 °C
• Complexity: 153
• Covalently-Bonded Unit Count: 1
• Decomposition: When heated to decomposition it emits acrid smoke and irritating fumes.
• EC Number: 210-817-6
• Exact Mass: 160.073559g/mol
• Formal Charge: 0
• H-Bond Acceptor: 4
• H-Bond Donor: 0
• Heavy Atom Count: 11
• ICSC Number: 0943
• LogP: 0.8
• Monoisotopic Mass: 160.073559g/mol
• NSC Number: 75843
• Refractive Index: INDEX OF REFRACTION: 1.4173 AT 20 °C/D;1.412-1.416
• Rotatable Bond Count: 5
• RTECS Number: TY4900000
• Vapor Density: Relative vapor density (air = 1): 1.0
• Vapor Pressure: Vapor pressure, Pa at 20 °C: 30
• Viscosity: 2.86 mm2/s at 20 °C
• XLogP3: 0.7

Custom Q&A

What is the molecular formula of 1,2-Propyleneglycol diacetate?

The molecular formula of 1,2-Propyleneglycol diacetate is C7H12O4.

What is the molecular weight of 1,2-Propyleneglycol diacetate?

The molecular weight of 1,2-Propyleneglycol diacetate is 160.17 g/mol.

What are some synonyms of 1,2-Propyleneglycol diacetate?

Some synonyms of 1,2-Propyleneglycol diacetate include Propylene glycol diacetate, 623-84-7, 1,2-Diacetoxypropane, and 1,2-Propanediol diacetate.

What is the IUPAC name of 1,2-Propyleneglycol diacetate?

The IUPAC name of 1,2-Propyleneglycol diacetate is 2-acetyloxypropyl acetate.

What is the InChI of 1,2-Propyleneglycol diacetate?

The InChI of 1,2-Propyleneglycol diacetate is InChI=1S/C7H12O4/c1-5(11-7(3)9)4-10-6(2)8/h5H,4H2,1-3H3.

What is the InChIKey of 1,2-Propyleneglycol diacetate?

The InChIKey of 1,2-Propyleneglycol diacetate is MLHOXUWWKVQEJB-UHFFFAOYSA-N.

What is the canonical SMILES of 1,2-Propyleneglycol diacetate?

The canonical SMILES of 1,2-Propyleneglycol diacetate is CC(COC(=O)C)OC(=O)C.

What is the CAS number of 1,2-Propyleneglycol diacetate?

The CAS number of 1,2-Propyleneglycol diacetate is 623-84-7.

What is the FEMA number of 1,2-Propyleneglycol diacetate?

The FEMA number of 1,2-Propyleneglycol diacetate is 4464.

What is the UNII of 1,2-Propyleneglycol diacetate?

The UNII of 1,2-Propyleneglycol diacetate is 5Z492UNF9O.