[2-(4-Benzylpiperazin-1-yl)phenyl]methanol supplier

Name
[2-(4-BENZYLPIPERAZIN-1-YL)PHENYL]METHANOL
EINECS
CAS No. 261178-24-9
Density 1.153 g/cm³
Solubility
Melting Point
Formula C₁₈H₂₂N₂O
Boiling Point 445.6 °C at 760 mmHg
Molecular Weight 282.385
Flash Point 226.2 °C
Transport Information
Appearance
Safety 61
Risk Codes 50
Molecular Structure
Hazard Symbols N
Synonyms [2-(4-Benzylpiperazin-1-yl)phenyl]methanol;
PSA 26.71000
LogP 2.50400

[2-(4-Benzylpiperazin-1-yl)phenyl]methanol Specification

This chemical is called [2-(4-Benzylpiperazin-1-yl)phenyl]methanol, and its CAS registry number is 261178-24-9. With the molecular formula of C₁₈H₂₂N₂O, its molecular weight is 282.38.

Other characteristics of the [2-(4-Benzylpiperazin-1-yl)phenyl]methanol can be summarised as followings: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.27; (4)ACD/LogD (pH 7.4): 2.09; (5)ACD/BCF (pH 5.5): 3.44; (6)ACD/BCF (pH 7.4): 22.25; (7)ACD/KOC (pH 5.5): 48.56; (8)ACD/KOC (pH 7.4): 314.04; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 15.71 Å²; (13)Index of Refraction: 1.616; (14)Molar Refractivity: 85.64 cm³; (15)Molar Volume: 244.8 cm³; (16)Polarizability: 33.95×10^-24cm³; (17)Surface Tension: 51.5 dyne/cm; (18)Density: 1.153 g/cm³; (19)Flash Point: 226.2 °C; (20)Enthalpy of Vaporization: 74.15 kJ/mol; (21)Boiling Point: 445.6 °C at 760 mmHg; (22)Vapour Pressure: 1.01E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: OCc3ccccc3N2CCN(Cc1ccccc1)CC2
2.InChI: InChI=1/C18H22N2O/c21-15-17-8-4-5-9-18(17)20-12-10-19(11-13-20)14-16-6-2-1-3-7-16/h1-9,21H,10-15H2
3.InChIKey: XMNZIYACKKYLJK-UHFFFAOYAA

Product Name

[2-(4-BENZYLPIPERAZIN-1-YL)PHENYL]METHANOL

[2-(4-Benzylpiperazin-1-yl)phenyl]methanol Specification

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