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90485-32-8

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Basic Information
CAS No.: 90485-32-8
Name: 1-(IODOMETHYL)-PIPERIDINE
Molecular Structure:
Molecular Structure of 90485-32-8 (1-(IODOMETHYL)-PIPERIDINE)
Formula: C6H12IN
Molecular Weight: 225.07
Synonyms: 1-(IODOMETHYL)-PIPERIDINE
Density: 1.637 g/cm3
Boiling Point: 199 °C at 760 mmHg
Flash Point: 74.2 °C
PSA: 3.24000
LogP: 1.80270
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  • 1-(Iodomethyl)-piperidine

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    90485-32-8

    1-(Iodomethyl)-piperidine

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    1-(Iodomethyl)piperidine

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    high purity Application:Drug intermediates Materials intermediates and active molecules

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Specification

This chemical is called Piperidine, 1-(iodomethyl)-, and its systematic name is 1-(Iodomethyl)-piperidine. With the molecular formula of C6H12IN, its molecular weight is 225.07. The CAS registry number of this chemical is 90485-32-8.

Other characteristics of the Piperidine, 1-(iodomethyl)- can be summarised as followings: (1)ACD/LogP: 2.37; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.11; (4)ACD/LogD (pH 7.4): 2.28; (5)ACD/BCF (pH 5.5): 2.05; (6)ACD/BCF (pH 7.4): 30.59; (7)ACD/KOC (pH 5.5): 25.57; (8)ACD/KOC (pH 7.4): 380.67; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.557; (14)Molar Refractivity: 44.28 cm3; (15)Molar Volume: 137.4 cm3; (16)Polarizability: 17.55×10-24cm3; (17)Surface Tension: 38.7 dyne/cm; (18)Density: 1.637 g/cm3; (19)Flash Point: 74.2 °C; (20)Enthalpy of Vaporization: 43.52 kJ/mol; (21)Boiling Point: 199 °C at 760 mmHg; (22)Vapour Pressure: 0.349 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: ICN1CCCCC1
2.InChI: InChI=1/C6H12IN/c7-6-8-4-2-1-3-5-8/h1-6H2
3.InChIKey: OLCWOQAPVNRXSO-UHFFFAOYAL