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Ethanamine,2-[[(4-methylphenyl)methyl]thio]-

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Name

Ethanamine,2-[[(4-methylphenyl)methyl]thio]-

EINECS N/A
CAS No. 106670-34-2 Density 1.049 g/cm3
PSA 51.32000 LogP 2.88720
Solubility N/A Melting Point N/A
Formula C10H15NS Boiling Point 289.7 °C at 760 mmHg
Molecular Weight 181.2978 Flash Point 129 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 106670-34-2 (2-[(4-METHYLBENZYL)THIO]ETHANAMINE) Hazard Symbols N/A
Synonyms

2-[(4-Methylbenzyl)sulfanyl]ethanamine;

Article Data 3

Ethanamine,2-[[(4-methylphenyl)methyl]thio]- Specification

The CAS registry number of Ethanamine,2-[[(4-methylphenyl)methyl]thio]- is 106670-34-2. This chemical's molecular formula is C10H15NS and molecular weight is 181.2978. What's more, its systematic name is 2-[(4-Methylbenzyl)sulfanyl]ethanamine. 

Physical properties about this chemical are: (1)ACD/LogP: 2.37; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 28.54 Å2; (7)Index of Refraction: 1.571; (8)Molar Refractivity: 56.79 cm3; (9)Molar Volume: 172.6 cm3; (10)Polarizability: 22.51×10-24 cm3; (11)Surface Tension: 42.5 dyne/cm; (12)Density: 1.049 g/cm3; (13)Flash Point: 129 °C; (14)Enthalpy of Vaporization: 52.9 kJ/mol; (15)Boiling Point: 289.7 °C at 760 mmHg; (16)Vapour Pressure: 0.00217 mmHg at 25 °C.

Preparation of Ethanamine,2-[[(4-methylphenyl)methyl]thio]-: this chemical is prepared by 2-Amino-ethanethiol; hydrochloride. This reaction needs reagent NaOEt and solvent ethanol by heating for 1.5 hours. The yield is 73 %. And the reaction equation is as followed:

Ethanamine,2-[[(4-methylphenyl)methyl]thio]- is prepared by 2-Amino-ethanethiol; hydrochloride

You can still convert the following datas into molecular structure:
(1) SMILES: S(CCN)Cc1ccc(cc1)C
(2) InChI: InChI=1/C10H15NS/c1-9-2-4-10(5-3-9)8-12-7-6-11/h2-5H,6-8,11H2,1H3
(3) InChIKey: LGOBOBXQLWNEPW-UHFFFAOYAY

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