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CAS No.: | 75653-87-1 |
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Name: | N-(3-AMINOPROPYL)-THIOMORPHOLINE |
Article Data: | 3 |
Molecular Structure: | |
Formula: | C7H16N2S |
Molecular Weight: | 160.283 |
Synonyms: | 4-(3-AMIOPROPYL)THIOMORPHOLINE HYDROCHLORIDE;N-(3-AMINOPROPYL)-THIOMORPHOLINE |
Density: | 1.035 g/cm3 |
Boiling Point: | 265.8 °C at 760 mmHg |
Flash Point: | 114.6 °C |
PSA: | 54.56000 |
LogP: | 1.02220 |
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The 4-Thiomorpholinepropanamine is an organic compound with the formula C7H16N2S. The systematic name of this chemical is 3-thiomorpholin-4-ylpropan-1-amine. With the CAS registry number 75653-87-1, it is also named as N-(3-Aminopropyl)-thiomorpholine.
Physical properties about 4-Thiomorpholinepropanamine are: (1)ACD/LogP: 0.25; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 2; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 4; (9)Polar Surface Area: 54.56 Å2; (10)Index of Refraction: 1.528; (11)Molar Refractivity: 47.67 cm3; (12)Molar Volume: 154.7 cm3; (13)Polarizability: 18.89×10-24cm3; (14)Surface Tension: 40 dyne/cm; (15)Density: 1.035 g/cm3; (16)Flash Point: 114.6 °C; (17)Enthalpy of Vaporization: 50.38 kJ/mol; (18)Boiling Point: 265.8 °C at 760 mmHg; (19)Vapour Pressure: 0.00894 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: NCCCN1CCSCC1
(2)InChI: InChI=1/C7H16N2S/c8-2-1-3-9-4-6-10-7-5-9/h1-8H2
(3)InChIKey: RECTZHBMZRYGEN-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H16N2S/c8-2-1-3-9-4-6-10-7-5-9/h1-8H2
(5)Std. InChIKey: RECTZHBMZRYGEN-UHFFFAOYSA-N