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3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine

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Name

3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine

EINECS N/A
CAS No. 176445-79-7 Density 1.06 /cm3
PSA 54.56000 LogP 1.08270
Solubility N/A Melting Point N/A
Formula C7H16N2S Boiling Point 244.8 °C at 760 mmHg
Molecular Weight 160.283 Flash Point 101.9 °C
Transport Information N/A Appearance N/A
Safety Risk Codes  C:Corrosive;
Molecular Structure Molecular Structure of 176445-79-7 (3-(AMINOMETHYL)-N,N-DIMETHYLTETRAHYDRO-3-THIOPHENAMINE) Hazard Symbols R34:Causes burns.;
Synonyms

3-(AMINOMETHYL)-N,N-DIMETHYLTETRAHYDRO-3-THIOPHENAMINE;3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine

Article Data 1

3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine Specification

The cas register number of 3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine is 176445-79-7. The Systematic name about this chemical is 3-(aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine. The Molecular Formula about this chemical is C7H16N2S.

Physical properties about 3-(Aminomethyl)-N,N-dimethyltetrahydrothiophen-3-amine are: (1)ACD/LogP: 0.21; (2)ACD/LogD (pH 5.5): -3.72; (3)ACD/LogD (pH 7.4): -2.63; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 31.78Å2; (12)Index of Refraction: 1.549; (13)Molar Refractivity: 47.93 cm3; (14)Molar Volume: 150.6 cm3; (15)Polarizability: 19x0-24cm3; (16)Surface Tension: 42.8 dyne/cm; (17)Enthalpy of Vaporization: 48.19 kJ/mol; (18)Boiling Point: 244.8 °C at 760 mmHg; (19)Vapour Pressure: 0.0297 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: S1CCC(N(C)C)(CN)C1
(2)InChI: InChI=1/C7H16N2S/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
(3)InChIKey: QSPJOBDYLWKZPW-UHFFFAOYAC
(4)Std. InChI: InChI=1S/C7H16N2S/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
(5)Std. InChIKey: QSPJOBDYLWKZPW-UHFFFAOYSA-N

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