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CAS No.: | 1614-82-0 |
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Name: | 1,4,5,8-Tetrahydro-2,7-dimethoxynaphthalene |
Molecular Structure: | |
Formula: | C12H16O2 |
Molecular Weight: | 192.258 |
Synonyms: | 2,7-dimethoxy-1,4,5,8-tetrahydronaphthalene; |
Density: | 1.061 g/cm3 |
Melting Point: | 64.0 to 68.0 °C |
Boiling Point: | 341.03 °C at 760 mmHg |
Flash Point: | 145.175 °C |
PSA: | 18.46000 |
LogP: | 2.93120 |
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The cas register number of 1,4,5,8-Tetrahydro-2,7-dimethoxynaphthalene is 1614-82-0. It also can be called as Naphthalene, 1,4,5,8-tetrahydro-2,7-dimethoxy- and the IUPAC Name about this chemical is 2,7-dimethoxy-1,4,5,8-tetrahydronaphthalene. Classification Code about this chemical is TSCA Flag P [A commenced PMN (Premanufacture Notice) substance].
Physical properties about 1,4,5,8-Tetrahydro-2,7-dimethoxynaphthalene are: (1)ACD/LogP: 1.88; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 26; (5)ACD/BCF (pH 7.4): 26; (6)ACD/KOC (pH 5.5): 354; (7)ACD/KOC (pH 7.4): 354; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 18.46Å2; (11)Index of Refraction: 1.528; (12)Molar Refractivity: 55.821 cm3; (13)Molar Volume: 181.267 cm3; (14)Polarizability: 22.129x10-24cm3; (15)Surface Tension: 34.781 dyne/cm; (16)Enthalpy of Vaporization: 56.15 kJ/mol; (17)Boiling Point: 341.03 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: COC\1=C\CC=2C\C=C(/CC=2C/1)OC
(2)InChI: InChI=1/C12H16O2/c1-13-11-5-3-9-4-6-12(14-2)8-10(9)7-11/h5-6H,3-4,7-8H2,1-2H3
(3)InChIKey: PWPPYWWWEVISEX-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C12H16O2/c1-13-11-5-3-9-4-6-12(14-2)8-10(9)7-11/h5-6H,3-4,7-8H2,1-2H3
(5)Std. InChIKey: PWPPYWWWEVISEX-UHFFFAOYSA-N