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767270-41-7

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Basic Information
CAS No.: 767270-41-7
Name: 4-METHYTHIO-PIPERIDINE
Molecular Structure:
Molecular Structure of 767270-41-7 (4-METHYTHIO-PIPERIDINE)
Formula: C6H13NS
Molecular Weight: 131.242
Synonyms: 4-METHYTHIO-PIPERIDINE;4-Meththiopiperidine
Density: 0.998 g/cm3
Boiling Point: 202.601 °C at 760 mmHg
Flash Point: 76.331 °C
PSA: 37.33000
LogP: 1.43020
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Specification

The Piperidine,4-(methylthio)- is an organic compound with the formula C6H13NS. The systematic name of this chemical is 4-(methylsulfanyl)piperidine. With the CAS registry number 767270-41-7, it is also named as 4-Methylthiopiperidine.

Physical properties about Piperidine,4-(methylthio)- are: (1)ACD/LogP: 0.98; (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: 1; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 37.33 Å2; (10)Index of Refraction: 1.511; (11)Molar Refractivity: 39.422 cm3; (12)Molar Volume: 131.507 cm3; (13)Polarizability: 15.628×10-24cm3; (14)Surface Tension: 34.76 dyne/cm; (15)Density: 0.998 g/cm3; (16)Flash Point: 76.331 °C; (17)Enthalpy of Vaporization: 43.882 kJ/mol; (18)Boiling Point: 202.601 °C at 760 mmHg; (19)Vapour Pressure: 0.29 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CSC1CCNCC1
(2)InChI: InChI=1/C6H13NS/c1-8-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3
(3)InChIKey: WGFYICOOQBENDY-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C6H13NS/c1-8-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3
(5)Std. InChIKey: WGFYICOOQBENDY-UHFFFAOYSA-N