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173601-36-0

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Basic Information
CAS No.: 173601-36-0
Name: 2-(2,4,6-TRIMETHYL-PHENYL)-ACETAMIDINE
Article Data: 1
Molecular Structure:
Molecular Structure of 173601-36-0 (2-(2,4,6-TRIMETHYL-PHENYL)-ACETAMIDINE)
Formula: C11H16N2
Molecular Weight: 176.261
Synonyms: (1Z)-2-(2,4,6-trimethylphenyl)ethanimidamide;
Density: 1.02 g/cm3
Boiling Point: 302.1 °C at 760 mmHg
Flash Point: 136.5 °C
PSA: 49.87000
LogP: 2.89030
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Specification

The Benzeneethanimidamide,2,4,6-trimethyl-, with the CAS registry number 173601-36-0, has the systematic name of (1Z)-2-(2,4,6-trimethylphenyl)ethanimidamide. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C11H16N2.

The characteristics of Benzeneethanimidamide,2,4,6-trimethyl- are as followings: (1)ACD/LogP: 1.86; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 3; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 15.6 Å2; (7)Index of Refraction: 1.539; (8)Molar Refractivity: 53.96 cm3; (9)Molar Volume: 172 cm3; (10)Polarizability: 21.39×10-24cm3; (11)Surface Tension: 34.1 dyne/cm; (12)Density: 1.02 g/cm3; (13)Flash Point: 136.5 °C; (14)Enthalpy of Vaporization: 54.23 kJ/mol; (15)Boiling Point: 302.1 °C at 760 mmHg; (16)Vapour Pressure: 0.00101 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [N@H]=C(N)Cc1c(cc(cc1C)C)C
(2)InChI: InChI=1/C11H16N2/c1-7-4-8(2)10(6-11(12)13)9(3)5-7/h4-5H,6H2,1-3H3,(H3,12,13)
(3)InChIKey: LJCUDFDOLRHFFO-UHFFFAOYAL