hydroxypropyl acrylate, mixture of isomers (25584-83-2)

The Hydroxypropyl acrylate, with its CAS registry number 25584-83-2, has the IUPAC name of 2-hydroxypropyl prop-2-enoate. This is a kind of clear colorless liquid, and it is usually applied in producing adhesives, thermohardening lacquer, fiber treating agent and lubricating oil additives.

The characteristics of this chemical are as below: (1)ACD/LogP: 0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 0.29; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 34.37; (8)ACD/KOC (pH 7.4): 34.37; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 35.53; (13)Index of Refraction: 1.442; (14)Molar Refractivity: 32.83 cm³; (15)Molar Volume: 124 cm³; (16)Polarizability: 13.01×10^-24 cm³; (17)Surface Tension: 33.6 dyne/cm; (18)Density: 1.049 g/cm³; (19)Flash Point: 79.9 °C; (20)Enthalpy of Vaporization: 50.12 kJ/mol; (21)Boiling Point: 194.5 °C at 760 mmHg; (22)Vapour Pressure: 0.115 mmHg at 25°C; (23)Exact Mass: 130.062994; (24)MonoIsotopic Mass: 130.062994; (25)Topological Polar Surface Area: 46.5; (26)Heavy Atom Count: 9; (27)Complexity: 109.

When you are dealing with this kind of chemical, you should be cautious. This is toxic which may at low levels cause damage to health. This chemical may causes burns and sensitisation by skin contact and it will be very dangerous if by inhalation, in contact with skin and if swallowed. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. If in case of contact with eyes, rinse immediately with plenty of water and seek medical advice, and if in case of accident or if you feel unwell seek medical advice immediately (show the label where possible).

In addition, you could convert the following datas into the molecular structure:
(1)Canonical SMILES: CC(COC(=O)C=C)O
(2)InChI: InChI=1S/C6H10O3/c1-3-6(8)9-4-5(2)7/h3,5,7H,1,4H2,2H3
(3)InChIKey: GWZMWHWAWHPNHN-UHFFFAOYSA-N