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CAS No.: | 6280-98-4 |
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Name: | 1,2-DI-N-PROPOXYBENZENE |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C12H18O2 |
Molecular Weight: | 194.274 |
Synonyms: | Benzene,o-dipropoxy- (7CI,8CI);1,2-Dipropoxybenzene;NSC 6192; |
Density: | 0.954 g/cm3 |
Boiling Point: | 235.9 °C at 760 mmHg |
Flash Point: | 74.1 °C |
PSA: | 18.46000 |
LogP: | 3.26420 |
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The Benzene, 1, 2-dipropoxy-, with the CAS registry number of 6280-98-4, is also known as Pyrocatechol dipropyl ether and Catechol dipropyl ether. This chemical's molecular formula is C12H18O2 and molecular weight is 194.27. What's more, its IUPAC name is 1, 2-Dipropoxybenzene.
Physical properties about Benzene, 1, 2-dipropoxy- are: (1)ACD/LogP: 4.08; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 6; (6)Polar Surface Area: 18.46 Å2; (7)Index of Refraction: 1.483; (8)Molar Refractivity: 58.14 cm3; (9)Molar Volume: 203.4 cm3; (10)Polarizability: 23.04×10-24 cm3; (11)Surface Tension: 30.9 dyne/cm; (12)Density: 0.954 g/cm3; (13)Flash Point: 74.1 °C; (14)Enthalpy of Vaporization: 45.35 kJ/mol; (15)Boiling Point: 235.9 °C at 760 mmHg; (16)Vapour Pressure: 0.0746 mmHg at 25°C.
Preparation: this chemical is prepared by reaction of Benzene-1, 2-diol with 1-Bromo-propane. The reaction needs reagent Potassium carbonate and solvent Acetone. The yield is about 98%.
Uses: it is used to produce other chemicals. For example, it is used to produce 1-Brom-3,4-di-n-propoxybenzol. This reaction needs reagent Br2. The yield is about 67%.
You can still convert the following datas into molecular structure:
(1) SMILES: O(c1ccccc1OCCC)CCC
(2) InChI: InChI=1/C12H18O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h5-8H,3-4,9-10H2,1-2H3
(3) InChIKey: XUIKECLBCZBUCM-UHFFFAOYAM