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25842-32-4

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Basic Information
CAS No.: 25842-32-4
Name: 2-(4-BENZYLPIPERIDINO)-1-ETHANAMINE
Article Data: 8
Molecular Structure:
Molecular Structure of 25842-32-4 (2-(4-BENZYLPIPERIDINO)-1-ETHANAMINE)
Formula: C14H22N2
Molecular Weight: 218.342
Synonyms: 1-(2-Aminoethyl)-4-benzylpiperid;2-(4-Benzylpiperidin-1-yl)ethanamine;2-[4-Benzylpiperidyl]ethylamine;2-(4-Benzylpiperidino)-1-ethanamine;
Density: 1.005 g/cm3
Boiling Point: 331.2 °C at 760 mmHg
Flash Point: 141.8 °C
Hazard Symbols: CorrosiveC, IrritantXi
Risk Codes: 34
Safety: 26-36/37/39
PSA: 29.26000
LogP: 2.53800
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Specification

The 1-Piperidineethanamine,4-(phenylmethyl)-, with the CAS registry number 25842-32-4, is also known as 1-(2-Aminoethyl)-4-benzylpiperidine. The molecular formula of this chemical is C14H22N2 and molecular weight is 218.34. What's more, its systematic name is 2-(4-Benzylpiperidin-1-yl)ethanamine.

Physical properties of 1-Piperidineethanamine,4-(phenylmethyl)- are: (1)ACD/LogP: 2.63; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.33; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1.51; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 6.48 Å2; (13)Index of Refraction: 1.545; (14)Molar Refractivity: 68.65 cm3; (15)Molar Volume: 217 cm3; (16)Polarizability: 27.21×10-24 cm3; (17)Surface Tension: 40.8 dyne/cm; (18)Density: 1.005 g/cm3; (19)Flash Point: 141.8 °C; (20)Enthalpy of Vaporization: 57.39 kJ/mol; (21)Boiling Point: 331.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000158 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
It can cause burns. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. When using it, you need wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(CCC1CC2=CC=CC=C2)CCN
(2)InChI: InChI=1S/C14H22N2/c15-8-11-16-9-6-14(7-10-16)12-13-4-2-1-3-5-13/h1-5,14H,6-12,15H2
(3)InChIKey: PCNDXYHWLSHXMV-UHFFFAOYSA-N