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Ethanamine,2-(4-methylphenoxy)-

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Name

Ethanamine,2-(4-methylphenoxy)-

EINECS N/A
CAS No. 26583-58-4 Density 1.008 g/cm3
PSA 35.25000 LogP 2.83480
Solubility N/A Melting Point N/A
Formula C9H13NO Boiling Point 253.7 °C at 760 mmHg
Molecular Weight 151.208 Flash Point 110.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 26583-58-4 (2-(4-METHYLPHENOXY)ETHANAMINE) Hazard Symbols Xn
Synonyms

Ethylamine,2-(p-tolyloxy)- (7CI,8CI);2-(4-Methylphenoxy)ethylamine;2-(p-Methylphenoxy)ethylamine;2-(4-methylphenoxy)ethanamine;2-p-Tolyloxy-ethylamine;Ethanamine, 2-(4-methylphenoxy)-;

Article Data 5

Ethanamine,2-(4-methylphenoxy)- Specification

The Ethanamine,2-(4-methylphenoxy)-, with the CAS registry number 26583-58-4, has the systematic name of 2-(4-methylphenoxy)ethanamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H13NO.

The characteristics of Ethanamine,2-(4-methylphenoxy)- are as followings: (1)ACD/LogP: 1.35; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.45; (4)ACD/LogD (pH 7.4): 0.13; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 7.77; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.524; (14)Molar Refractivity: 45.92 cm3; (15)Molar Volume: 149.8 cm3; (16)Polarizability: 18.2×10-24cm3; (17)Surface Tension: 37.2 dyne/cm; (18)Density: 1.008 g/cm3; (19)Flash Point: 110.2 °C; (20)Enthalpy of Vaporization: 49.11 kJ/mol; (21)Boiling Point: 253.7 °C at 760 mmHg; (22)Vapour Pressure: 0.018 mmHg at 25°C.  

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c1ccc(cc1)C)CCN
(2)InChI: InChI=1/C9H13NO/c1-8-2-4-9(5-3-8)11-7-6-10/h2-5H,6-7,10H2,1H3
(3)InChIKey: WRJHHZOBJGDIHT-UHFFFAOYAZ

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