Piperazine,1-(4-phenylbutyl)- supplier

Name
1-(4-PHENYLBUTYL)-PIPERAZINE
EINECS
CAS No. 97480-93-8
Density 0.971 g/cm³
Solubility
Melting Point
Formula C₁₄H₂₂N₂
Boiling Point 343.3 °C at 760 mmHg
Molecular Weight 218.34
Flash Point 138.4 °C
Transport Information
Appearance
Safety 45
Risk Codes 25
Molecular Structure
Hazard Symbols Xi
Synonyms N-(4-Phenylbutyl)piperazine;1-(4-Phenylbutyl)piperazine;
PSA 15.27000
LogP 2.18120

Piperazine,1-(4-phenylbutyl)- Specification

The Piperazine,1-(4-phenylbutyl)- is an organic compound with the formula C₁₄H₂₂N₂. The IUPAC name of this chemical is 1-(4-phenylbutyl)piperazine. With the CAS registry number 97480-93-8, the product's category is Piperazines.

Physical properties about Piperazine,1-(4-phenylbutyl)- are: (1)ACD/LogP: 2.54; (2)ACD/LogD (pH 5.5): -0.5; (3)ACD/LogD (pH 7.4): 0.62; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 6.86; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 5; (11)Polar Surface Area: 6.48 Å²; (12)Index of Refraction: 1.52; (13)Molar Refractivity: 68.44 cm³; (14)Molar Volume: 224.8 cm³; (15)Polarizability: 27.13×10^-24cm³; (16)Surface Tension: 35.6 dyne/cm; (17)Density: 0.971 g/cm³; (18)Flash Point: 138.4 °C; (19)Enthalpy of Vaporization: 58.72 kJ/mol; (20)Boiling Point: 343.3 °C at 760 mmHg; (21)Vapour Pressure: 7.1E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N2CCN(CCCCc1ccccc1)CC2
(2)InChI: InChI=1/C14H22N2/c1-2-6-14(7-3-1)8-4-5-11-16-12-9-15-10-13-16/h1-3,6-7,15H,4-5,8-13H2
(3)InChIKey: OHFQSNUBVNIZRV-UHFFFAOYAE
(4)Std. InChI: InChI=1S/C14H22N2/c1-2-6-14(7-3-1)8-4-5-11-16-12-9-15-10-13-16/h1-3,6-7,15H,4-5,8-13H2
(5)Std. InChIKey: OHFQSNUBVNIZRV-UHFFFAOYSA-N

Product Name

1-(4-PHENYLBUTYL)-PIPERAZINE

Piperazine,1-(4-phenylbutyl)- Specification

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