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Name |
2-Hydroxypropyl acetate |
EINECS | N/A |
CAS No. | 627-69-0 | Density | 1.051 g/cm3 |
PSA | 60.36000 | LogP | -1.10270 |
Solubility | N/A | Melting Point |
N/A |
Formula | C5H10O3 | Boiling Point | 191.006 °C at 760 mmHg |
Molecular Weight | 118.133 | Flash Point | 77.459 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
1,2-Propanediol, 1-acetate;Propylene glycol 1-acetate; |
Article Data | 5 |
The 2-Hydroxypropyl acetate, with the CAS registry number 627-69-0, is also known as 1-Acetoxy-2-hydroxypropane. This chemical's molecular formula is C5H10O3 and molecular weight is 118.13. What's more, its IUPAC name is the same with its product name.
Physical properties about 2-Hydroxypropyl acetate are: (1)ACD/LogP: -0.17; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.17; (4)ACD/LogD (pH 7.4): -0.17; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 19.26; (8)ACD/KOC (pH 7.4): 19.26; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 46.5; (13)Molar Refractivity: 28.482 cm3; (14)Molar Volume: 112.434 cm3; (15)Polarizability: 11.291×10-24cm3; (16)Surface Tension: 33.218 dyne/cm; (17)Density: 1.051 g/cm3; (18)Flash Point: 77.459 °C; (19)Enthalpy of Vaporization: 49.717 kJ/mol; (20)Boiling Point: 191.006 °C at 760 mmHg; (21)Vapour Pressure: 0.1420 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(OCC(O)C)C
(2) InChI: InChI=1S/C5H10O3/c1-4(6)3-8-5(2)7/h4,6H,3H2,1-2H3
(3) InChIKey: PPPFYBPQAPISCT-UHFFFAOYSA-N