4-Piperidinol,4-(aminomethyl)-1-(2-phenylethyl)- supplier

Name
4-(aminomethyl)-1-phenethylpiperidin-4-ol
EINECS 245-896-6
CAS No. 23808-42-6
Article Data10
CAS DataBase
Density 1.085 g/cm³
Solubility
Melting Point
Formula C₁₄H₂₂N₂O
Boiling Point 387.6 °C at 760 mmHg
Molecular Weight 234.341
Flash Point 188.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Piperidinol,4-(aminomethyl)-1-phenethyl- (8CI);
PSA 49.49000
LogP 1.65290

4-Piperidinol,4-(aminomethyl)-1-(2-phenylethyl)- Specification

The 4-Piperidinol,4-(aminomethyl)-1-(2-phenylethyl)-, with the CAS registry number 23808-42-6, has the IUPAC name 4-(aminomethyl)-1-(2-phenylethyl)piperidin-4-ol. Its molecular formula is C₁₄H₂₂N₂O and its molecular weight is 234.33728. Additionally, its EINECS is 245-896-6.

Other characteristics of the 4-Piperidinol,4-(aminomethyl)-1-(2-phenylethyl)- can be summarised as followings: (1)ACD/LogP: 0.83; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.26; (4)ACD/LogD (pH 7.4): -2.64; (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; (9)#H bond acceptors: 3; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 15.71 Å²; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 70.16 cm³; (15)Molar Volume: 215.9 cm³; (16)Polarizability: 27.81×10^-24cm³; (17)Surface Tension: 46.5 dyne/cm; (18)Density: 1.085 g/cm³; (19)Flash Point: 188.2 °C; (20)Enthalpy of Vaporization: 67.16 kJ/mol; (21)Boiling Point: 387.6 °C at 760 mmHg; (22)Vapour Pressure: 1.06E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OC2(CCN(CCc1ccccc1)CC2)CN
2.InChI: InChI=1/C14H22N2O/c15-12-14(17)7-10-16(11-8-14)9-6-13-4-2-1-3-5-13/h1-5,17H,6-12,15H2
3.InChIKey: OZWUDZJANOCZLG-UHFFFAOYAE

Product Name

4-(aminomethyl)-1-phenethylpiperidin-4-ol

4-Piperidinol,4-(aminomethyl)-1-(2-phenylethyl)- Specification

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