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4740-77-6

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Basic Information
CAS No.: 4740-77-6
Name: 2,6-dimethyl-1,3-dioxan-4-ol
Article Data: 12
Molecular Structure:
Molecular Structure of 4740-77-6 (2,6-dimethyl-1,3-dioxan-4-ol)
Formula: C6H12O3
Molecular Weight: 132.159
Synonyms: 4-m-Dioxanol,2,6-dimethyl- (4CI);m-Dioxan-4-ol, 2,6-dimethyl- (7CI,8CI);2,6-Dimethyl-1,3-dioxan-4-ol;Acetaldehyde, cyclic 1-hydroxy-3-methyltrimethyleneacetal;
EINECS: 225-247-3
Density: 1.052 g/cm3
Boiling Point: 204.8 °C at 760 mmHg
Flash Point: 77.6 °C
PSA: 38.69000
LogP: 0.47620
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  • 1,3-DIOXAN-4-OL,2,6-DIMETHYL-CAS

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    1,3-DIOXAN-4-OL,2,6-DIMETHYL-CAS

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    1,3-DIOXAN-4-OL,2,6-DIMETHYL-CASAppearance:white crystalline powder Storage:Store in dry, dark and ventilated place Package:25KG drum Application:intermediate Transportation:by air, by sea, by express

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Specification

The CAS register number of 1,3-Dioxan-4-ol,2,6-dimethyl- is 4740-77-6. It also can be called as Acetaldehyde, cyclic 1-hydroxy-3-methyltrimethyleneacetal and the systematic name about this chemical is 2,6-dimethyl-1,3-dioxan-4-ol. The molecular formula about this chemical is C6H12O3 and the molecular weight is 132.15768.

Physical properties about 1,3-Dioxan-4-ol,2,6-dimethyl- are: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 23.92; (4)ACD/KOC (pH 7.4): 23.92; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 27.69 Å2; (9)Index of Refraction: 1.433; (10)Molar Refractivity: 32.66 cm3; (11)Molar Volume: 125.5 cm3; (12)Polarizability: 12.94x10-24cm3; (13)Surface Tension: 30.4 dyne/cm; (14)Density: 1.052 g/cm3; (15)Flash Point: 77.6 °C; (16)Enthalpy of Vaporization: 51.3 kJ/mol; (17)Boiling Point: 204.8 °C at 760 mmHg; (18)Vapour Pressure: 0.062 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: OC1OC(OC(C)C1)C
(2)InChI: InChI=1/C6H12O3/c1-4-3-6(7)9-5(2)8-4/h4-7H,3H2,1-2H3
(3)InChIKey: XOXZKNZCICKTLL-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H12O3/c1-4-3-6(7)9-5(2)8-4/h4-7H,3H2,1-2H3
(5)Std. InChIKey: XOXZKNZCICKTLL-UHFFFAOYSA-N