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883541-34-2

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Basic Information
CAS No.: 883541-34-2
Name: 4-(Aminomethyl)-1-(thien-2-ylmethyl)piperidine
Molecular Structure:
Molecular Structure of 883541-34-2 (4-(Aminomethyl)-1-(thien-2-ylmethyl)piperidine)
Formula: C11H18N2S
Molecular Weight: 210.33902
Synonyms: 4-(Aminomethyl)-1-(thien-2-ylmethyl)piperidine;4-(Aminomethyl)-1-(thien-2-ylmethyl)piperidine 97%;1-(THIEN-2-YLMETHYL)PIPERID-4-YL]METHYLAMINE;[1-(thien-2-ylmethyl)piperidin-4-yl]methylamine
Density: 1.107g/cm3
Boiling Point: 304.352 °C at 760 mmHg
Flash Point: 137.868 °C
Hazard Symbols: CorrosiveC
PSA: 57.50000
LogP: 2.55700
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Specification

The 4-Piperidinemethanamine,1-(2-thienylmethyl)-, with CAS registry number 883541-34-2, has the systematic name of 1-[1-(thiophen-2-ylmethyl)piperidin-4-yl]methanamine. Besides this, it is also called 4-(Aminomethyl)-1-(thien-2-ylmethyl)piperidine. And the chemical formula of this chemical is C11H18N2S.

Physical properties of 4-Piperidinemethanamine,1-(2-thienylmethyl)-: (1)ACD/LogP: 2.09; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 2; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 4; (10)Polar Surface Area: 57.5 Å2; (11)Index of Refraction: 1.571; (12)Molar Refractivity: 62.405 cm3; (13)Molar Volume: 190.04 cm3; (14)Polarizability: 24.739×10-24cm3; (15)Surface Tension: 45.48 dyne/cm; (16)Density: 1.107 g/cm3; (17)Flash Point: 137.868 °C; (18)Enthalpy of Vaporization: 54.471 kJ/mol; (19)Boiling Point: 304.352 °C at 760 mmHg; (20)Vapour Pressure: 0.001 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: NCC2CCN(Cc1cccs1)CC2
(2)InChI: InChI=1/C11H18N2S/c12-8-10-3-5-13(6-4-10)9-11-2-1-7-14-11/h1-2,7,10H,3-6,8-9,12H2
(3)InChIKey: KZGFXYFQDXOLOP-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C11H18N2S/c12-8-10-3-5-13(6-4-10)9-11-2-1-7-14-11/h1-2,7,10H,3-6,8-9,12H2
(5)Std. InChIKey: KZGFXYFQDXOLOP-UHFFFAOYSA-N