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3-Ethylpiperidine

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Name

3-Ethylpiperidine

EINECS N/A
CAS No. 13603-10-6 Density 0.808 g/cm3
PSA 12.03000 LogP 1.72480
Solubility N/A Melting Point 149 °C
Formula C7H15N Boiling Point 152.6 °C at 760 mmHg
Molecular Weight 113.203 Flash Point 33.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 13603-10-6 (3-Ethylpiperidine) Hazard Symbols N/A
Synonyms

beta-Aethylpiperidin [German];Piperidine, 3-ethyl-;

Article Data 12

3-Ethylpiperidine Specification

This chemical is called 3-Ethylpiperidine, and it's also named as Piperidine, 3-ethyl-. With the molecular formula of C7H15N, its molecular weight is 113.20. The CAS registry number of this chemical is 13603-10-6.

Other characteristics of the 3-Ethylpiperidine can be summarised as followings: (1)ACD/LogP: 1.96; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 3.24 Å2; (7)Index of Refraction: 1.423; (8)Molar Refractivity: 35.73 cm3; (9)Molar Volume: 140 cm3; (10)Polarizability: 14.16×10-24cm3; (11)Surface Tension: 26.2 dyne/cm; (12)Density: 0.808 g/cm3; (13)Flash Point: 33.8 °C; (14)Enthalpy of Vaporization: 38.94 kJ/mol; (15)Boiling Point: 152.6 °C at 760 mmHg; (16)Vapour Pressure: 3.47 mmHg at 25°C.

You can still convert the following datas into molecular structure: 
1.SMILES: N1CCCC(CC)C1
2.InChI: InChI=1/C7H15N/c1-2-7-4-3-5-8-6-7/h7-8H,2-6H2,1H3
3.InChIKey: YLUDSYGJHAQGOD-UHFFFAOYAC

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LDLo subcutaneous 300mg/kg (300mg/kg)   Berichte der Deutschen Chemischen Gesellschaft. Vol. 34, Pg. 2408, 1901.

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