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CAS No.: | 947252-23-5 |
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Name: | 2-Acetoxy-2-methyl-1-propanol |
Molecular Structure: | |
Formula: | C6H12O3 |
Molecular Weight: | 132.15768 |
Synonyms: | (2-hydroxy-1,1-dimethyl-ethyl) acetate; |
Density: | 1.027 g/cm3 |
Boiling Point: | 201.7 °C at 760 mmHg |
Flash Point: | 79.5 °C |
PSA: | 46.53000 |
LogP: | 0.32040 |
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The 2-Acetoxy-2-methyl-1-propanol is an organic compound with the formula C6H12O3. With the CAS registry number 947252-23-5, its systematic name is (2-hydroxy-1,1-dimethyl-ethyl) acetate.
Physical properties of 2-Acetoxy-2-methyl-1-propanol: (1)ACD/LogP: 0.05; (2)ACD/LogD (pH 5.5): 0.04; (3)ACD/LogD (pH 7.4): 0.04; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 4; (7)Index of Refraction: 1.428; (8)Molar Refractivity: 33.12 cm3; (9)Molar Volume: 128.6 cm3; (10)Surface Tension: 32.6 dyne/cm; (11)Density: 1.027 g/cm3; (12)Flash Point: 79.5 °C; (13)Enthalpy of Vaporization: 50.95 kJ/mol; (14)Boiling Point: 201.7 °C at 760 mmHg; (15)Vapour Pressure: 0.0747 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: CC(=O)OC(C)(C)CO
(2)InChI: InChI=1/C6H12O3/c1-5(8)9-6(2,3)4-7/h7H,4H2,1-3H3
(3)InChIKey: GWOKHTMCBUZSOP-UHFFFAOYAA