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2-Hydroxymethyloxetane

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Name

2-Hydroxymethyloxetane

EINECS N/A
CAS No. 61266-70-4 Density 1.093 g/cm3
PSA 29.46000 LogP -0.23240
Solubility Slightly soluble in water. Melting Point N/A
Formula C4H8O2 Boiling Point 168.784 °C at 760 mmHg
Molecular Weight 88.1063 Flash Point 78.798 °C
Transport Information N/A Appearance N/A
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 61266-70-4 (2-Hydroxymethyloxetane) Hazard Symbols N/A
Synonyms

2-HYDROXYMETHYLOXETANE;2-OXETANEMETHANOL;2,4-EPOXYBUTANOL;2-Hydroxymethyloxethane;oxetan-2-ylMethanol;2,4-Epoxybutanol 2-Oxetanemethanol

Article Data 7

2-Hydroxymethyloxetane Specification

The 2-Hydroxymethyloxetane, with the CAS registry number of 61266-70-4, is also known as 2-Oxetanemethanol. It belongs to the product categories of Oxetanes; Simple 4-Membered Ring Compounds. Its molecular formula is C4H8O2 and molecular weight is 88.11. What's more, its systematic name is Oxetan-2-ylmethanol. In addition, it must be stored in airtight containers and placed in a dry, cool place.

Physical properties about the 2-Hydroxymethyloxetane are: (1)ACD/LogP: -0.75; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 9; (6)ACD/KOC (pH 7.4): 9; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 29.46 Å2; (11)Index of Refraction: 1.45; (12)Molar Refractivity: 21.669 cm3; (13)Molar Volume: 80.592 cm3; (14)Surface Tension: 42.526 dyne/cm; (15)Density: 1.093 g/cm3; (16)Flash Point: 78.798 °C; (17)Enthalpy of Vaporization: 47.183 kJ/mol; (18)Boiling Point: 168.784 °C at 760 mmHg; (19)Vapour Pressure: 0.518 mmHg at 25 °C.

Preparation: this chemical is prepared by 2-(1-Ethoxyethoxy)methyloxetane. The reaction needs reagent HOAc. The yield is about 74 %.

The 2-Hydroxymethyloxetane can be obtained by 2-(1-Ethoxyethoxy)methyloxetane

Uses: it is used to produce other chemicals. For example, it is used to produce Toluene-4-sulfonic acid oxetan-2-ylmethyl ester. This reaction needs reagent Pyridine. The reaction time is 1 h with reaction temperature of 0 °C. The yield is about 73 %.

The 2-Hydroxymethyloxetane can react with Toluene-4-sulfonyl chloride to get Toluene-4-sulfonic acid oxetan-2-ylmethyl ester

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1) SMILES: OCC1CCO1
(2) InChI: InChI=1/C4H8O2/c5-3-4-1-2-6-4/h4-5H,1-3H2
(3) InChIKey: PQZJTHGEFIQMCO-UHFFFAOYAJ

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