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CAS No.: | 6972-79-8 |
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Name: | 1,3-BIS(BENZYLOXY)-2-PROPANOL |
Article Data: | 40 |
Molecular Structure: | |
Formula: | C17H20O3 |
Molecular Weight: | 272.344 |
Synonyms: | 2-Propanol,1,3-bis(benzyloxy)- (6CI,8CI);1,3-Benzyloxy-2-propanol;1,3-Bis(benzyloxy)-2-propanol;1,3-Di-O-benzylglycerol;1,3-Dibenzyl glycerol;1,3-Dibenzylglycerin;1,3-Dibenzyloxy-2-hydroxypropane;1,3-Dibenzyloxy-2-propanol;1,3-O-Dibenzylglycerin;NSC 62583; |
Density: | 1.12 g/cm3 |
Boiling Point: | 413.3 °C at 760 mmHg |
Flash Point: | 207.4 °C |
Appearance: | Pale-Yellow Oil |
Safety: | 23-24/25 |
PSA: | 38.69000 |
LogP: | 2.78090 |
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The 2-Propanol,1,3-bis(phenylmethoxy)-, with the CAS registry number 6972-79-8, has the systematic name of 1,3-bis(benzyloxy)propan-2-ol. And the molecular formula of this chemical is C17H20O3. It is a kind of pale-yellow oil, and belongs to the following product categories: All Aliphatics; Aliphatics; Aromatics; Intermediates. What's more, it should be stored in the refrigerator.
The physical properties of 2-Propanol,1,3-bis(phenylmethoxy)- are as following: (1)ACD/LogP: 3.83; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 9; (6)Polar Surface Area: 27.69 Å2; (7)Index of Refraction: 1.564; (8)Molar Refractivity: 79.17 cm3; (9)Molar Volume: 243 cm3; (10)Polarizability: 31.38×10-24cm3; (11)Surface Tension: 44.7 dyne/cm; (12)Density: 1.12 g/cm3; (13)Flash Point: 207.4 °C; (14)Enthalpy of Vaporization: 70.23 kJ/mol; (15)Boiling Point: 413.3 °C at 760 mmHg; (16)Vapour Pressure: 1.42E-07 mmHg at 25°C.
Preparation of 2-Propanol,1,3-bis(phenylmethoxy)-: This chemical can be prepared by chloromethyl-oxirane and phenylmethanol. The reaction will need reagent KOH.
Uses of 2-Propanol,1,3-bis(phenylmethoxy)-: It can react with chloromethoxy-ethane to produce 2-Ethoxymethoxy-1,3-dibenzyloxy-propan. This reaction will need reagent PhNMe2, and the solvent benzene.
You should be cautious while dealing with this chemical: Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer); Avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)SMILES: O(CC(O)COCc1ccccc1)Cc2ccccc2
(2)InChI: InChI=1/C17H20O3/c18-17(13-19-11-15-7-3-1-4-8-15)14-20-12-16-9-5-2-6-10-16/h1-10,17-18H,11-14H2
(3)InChIKey: ARLSYSVVBAMYKA-UHFFFAOYAC