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| CAS No.: | 16545-68-9 |
|---|---|
| Name: | Cyclopropanol |
| Molecular Structure: | |
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| Formula: | C3H6O |
| Molecular Weight: | 58.08 |
| Synonyms: | Cyclopropyl alcohol;Hydroxycyclopropane; |
| Density: | 1.156 g/cm3 |
| Melting Point: | 180℃ |
| Boiling Point: | 90.4 °C at 760 mmHg |
| Flash Point: | 22.2 °C |
| PSA: | 20.23000 |
| LogP: | 0.14110 |
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Specification
The Cyclopropanol is an organic compound with the formula C3H6O. The IUPAC name of this chemical is Cyclopropanol. With the CAS registry number 16545-68-9, it is also named as Cyclopropane-1-ol. Besides, its molecular weight is 58.0791. The compound is highly unstable due to the three-membered ring, and is susceptible to reactions that open the ring. This property is useful synthetically: cyclopropanol can be used as a synthon for the homoenolate of propanal. The chemical is also useful as a reagent to introduce a cyclopropyl group into ester, sulfate, and amine linkages.
Physical properties about Cyclopropanol are: (1)ACD/LogP: -0.35; (2)ACD/LogD (pH 5.5): -0.35; (3)ACD/LogD (pH 7.4): -0.35; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 15.33; (7)ACD/KOC (pH 7.4): 15.33; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 9.23 Å2; (12)Index of Refraction: 1.526; (13)Molar Refractivity: 15.42 cm3; (14)Molar Volume: 50.2 cm3; (15)Polarizability: 6.11×10-24 cm3; (16)Surface Tension: 40.6 dyne/cm; (17)Density: 1.156 g/cm3; (18)Flash Point: 22.2 °C; (19)Enthalpy of Vaporization: 38.52 kJ/mol; (20)Boiling Point: 90.4 °C at 760 mmHg; (21)Vapour Pressure: 34.4 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C3H6O/c4-3-1-2-3/h3-4H,1-2H2
(2)InChIKey: YOXHCYXIAVIFCZ-UHFFFAOYAP
(3)Std. InChI: InChI=1S/C3H6O/c4-3-1-2-3/h3-4H,1-2H2
(4)Std. InChIKey: YOXHCYXIAVIFCZ-UHFFFAOYSA-N