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CAS No.: | 147730-26-5 |
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Name: | (3-ethoxy-4-methoxyphenyl)methanol |
Molecular Structure: | |
Formula: | C10H14O3 |
Molecular Weight: | 182.21636 |
Synonyms: | 3-Ethoxy-4-methoxybenzyl alcohol; |
Density: | 1.086 g/cm3 |
Boiling Point: | 303.7 °C at 760 mmHg |
Flash Point: | 131 °C |
PSA: | 38.69000 |
LogP: | 1.58620 |
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The Benzenemethanol, 3-ethoxy-4-methoxy-, with the CAS registry number 147730-26-5, is also known as 3-Ethoxy-4-methoxybenzyl alcohol. This chemical's molecular formula is C10H14O3 and molecular weight is 182.21636. What's more, its IUPAC name is (3-Ethoxy-4-methoxyphenyl)methanol.
Physical properties about Benzenemethanol, 3-ethoxy-4-methoxy- are: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.3; (4)ACD/LogD (pH 7.4): 1.3; (5)ACD/BCF (pH 5.5): 5.76; (6)ACD/BCF (pH 7.4): 5.76; (7)ACD/KOC (pH 5.5): 121.85; (8)ACD/KOC (pH 7.4): 121.85; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 27.69 Å2; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 50.69 cm3; (15)Molar Volume: 167.7 cm3; (16)Polarizability: 20.09×10-24 cm3; (17)Surface Tension: 37 dyne/cm; (18)Density: 1.086 g/cm3; (19)Flash Point: 131 °C; (20)Enthalpy of Vaporization: 57.44 kJ/mol; (21)Boiling Point: 303.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000404 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O(c1cc(ccc1OC)CO)CC
(2) InChI: InChI=1/C10H14O3/c1-3-13-10-6-8(7-11)4-5-9(10)12-2/h4-6,11H,3,7H2,1-2H3
(3) InChIKey: DPHGMDVPFZLOBU-UHFFFAOYSA-N