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224178-67-0

Basic Information
CAS No.: 224178-67-0
Name: 4-(PIPERIDIN-4-YLOXY)BENZONITRILE
Article Data: 6
Molecular Structure:
Molecular Structure of 224178-67-0 (4-(PIPERIDIN-4-YLOXY)BENZONITRILE)
Formula: C12H14N2O
Molecular Weight: 202.256
Synonyms: 4-(4-Cyanophenoxy)piperidine;4-(Piperidin-4-yloxy)benzonitrile;
Density: 1.13 g/cm3
Boiling Point: 366.8 °C at 760mmHg
Flash Point: 175.6 °C
PSA: 45.05000
LogP: 2.01788
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Specification

The CAS registry number of Benzonitrile,4-(4-piperidinyloxy)- is 224178-67-0. This chemical's molecular formula is C12H14N2O and molecular weight is 202.25. What's more, its systematic name is called 4-(Piperidin-4-yloxy)benzonitrile. In addition, this chemical should be stored in a cool, dry and sealing place.

Physical properties about Benzonitrile,4-(4-piperidinyloxy)- are: (1)ACD/LogP: 1.86; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.23; (4)ACD/LogD (pH 7.4): -0.66; (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: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 36.26 Å2; (13)Index of Refraction: 1.563; (14)Molar Refractivity: 57.79 cm3; (15)Molar Volume: 177.9 cm3; (16)Polarizability: 22.91×10-24 cm3; (17)Surface Tension: 48.1 dyne/cm; (18)Density: 1.13 g/cm3; (19)Flash Point: 175.6 °C; (20)Enthalpy of Vaporization: 61.32 kJ/mol; (21)Boiling Point: 366.8 °C at 760 mmHg; (22)Vapour Pressure: 1.43E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: N#Cc2ccc(OC1CCNCC1)cc2
(2) InChI: InChI=1/C12H14N2O/c13-9-10-1-3-11(4-2-10)15-12-5-7-14-8-6-12/h1-4,12,14H,5-8H2
(3) InChIKey: DRIREFRFHFBPIN-UHFFFAOYAQ