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1600-19-7

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Basic Information
CAS No.: 1600-19-7
Name: Xyloxemine
Article Data: 2
Molecular Structure:
Molecular Structure of 1600-19-7 (Xyloxemine)
Formula: C23H33NO2
Molecular Weight: 355.52
Synonyms: Ethylamine,2-[2-(di-2,6-xylylmethoxy)ethoxy]-N,N-dimethyl- (6CI,7CI,8CI);2-[2-(Di-2,6-xylylmethoxy)ethoxy]-N,N-dimethylethylamine;Xyloxemine;
Density: 1.005g/cm3
Boiling Point: 458.8 °C at 760 mmHg
Flash Point: 175.8 °C
PSA: 21.70000
LogP: 4.60440
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Specification

The Xyloxemine is an organic compound with the formula C23H33NO2. The IUPAC name of this chemical is 2-[2-[bis(2,6-dimethylphenyl)methoxy]ethoxy]-N,N-dimethylethanamine. With the CAS registry number 1600-19-7, it is also named as Ethanamine, 2-[2-[bis(2,6-dimethylphenyl)methoxy]ethoxy]-N,N-dimethyl-.

Physical properties about Xyloxemine are: (1)ACD/LogP: 4.78; (2)ACD/LogD (pH 5.5): 1.89; (3)ACD/LogD (pH 7.4): 3.37; (4)ACD/BCF (pH 5.5): 3.28; (5)ACD/BCF (pH 7.4): 99.4; (6)ACD/KOC (pH 5.5): 12.32; (7)ACD/KOC (pH 7.4): 373.3; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 9; (10)Polar Surface Area: 21.7 Å2; (11)Index of Refraction: 1.533; (12)Molar Refractivity: 109.87 cm3; (13)Molar Volume: 353.7 cm3; (14)Polarizability: 43.55×10-24cm3; (15)Surface Tension: 36.8 dyne/cm; (16)Density: 1.005 g/cm3; (17)Flash Point: 175.8 °C; (18)Enthalpy of Vaporization: 71.92 kJ/mol; (19)Boiling Point: 458.8 °C at 760 mmHg; (20)Vapour Pressure: 1.33E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O(CCOCCN(C)C)C(c1c(cccc1C)C)c2c(cccc2C)C
(2)InChI: InChI=1/C23H33NO2/c1-17-9-7-10-18(2)21(17)23(22-19(3)11-8-12-20(22)4)26-16-15-25-14-13-24(5)6/h7-12,23H,13-16H2,1-6H3
(3)InChIKey: KLOZENAJUCRQKD-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C23H33NO2/c1-17-9-7-10-18(2)21(17)23(22-19(3)11-8-12-20(22)4)26-16-15-25-14-13-24(5)6/h7-12,23H,13-16H2,1-6H3
(5)Std. InChIKey: KLOZENAJUCRQKD-UHFFFAOYSA-N