Basic Information | Post buying leads | Suppliers |
Name |
1-(4-Cyanophenyl)-4-piperidinecarbohydrazide |
EINECS | N/A |
CAS No. | 352018-91-8 | Density | 1.251 g/cm3 |
PSA | 82.15000 | LogP | 1.92078 |
Solubility | N/A | Melting Point |
N/A |
Formula | C13H16N4O | Boiling Point | 528.975 °C at 760 mmHg |
Molecular Weight | 244.29 | Flash Point | 273.715 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes |
Xn:Harmful; |
|
Molecular Structure | Hazard Symbols | R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; | |
Synonyms |
1-(4-Cyanophenyl)piperidine-4-carbohydrazide;4-Piperidinecarboxylic acid, 1-(4-cyanophenyl)-, hydrazide; |
The 1-(4-Cyanophenyl)-4-piperidinecarbohydrazide, with the CAS registry number 352018-91-8, is also known as 4-Piperidinecarboxylic acid, 1-(4-cyanophenyl)-, hydrazide. This chemical's molecular formula is C13H16N4O and molecular weight is 244.29. What's more, its systematic name is 1-(4-cyanophenyl)piperidine-4-carbohydrazide.
Physical properties of 1-(4-Cyanophenyl)-4-piperidinecarbohydrazide are: (1)ACD/LogP: 0.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.251; (4)ACD/LogD (pH 7.4): 0.253; (5)ACD/BCF (pH 5.5): 1; (6)ACD/KOC (pH 5.5): 32.558; (7)ACD/KOC (pH 7.4): 32.694; (8)#H bond acceptors: 5; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 82.15 Å2; (12)Index of Refraction: 1.617; (13)Molar Refractivity: 68.31 cm3; (14)Molar Volume: 195.233 cm3; (15)Surface Tension: 62.826 dyne/cm; (16)Density: 1.251 g/cm3; (17)Flash Point: 273.715 °C; (18)Enthalpy of Vaporization: 80.391 kJ/mol; (19)Boiling Point: 528.975 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CN(CCC1C(=O)NN)C2=CC=C(C=C2)C#N
(2)InChI: InChI=1S/C13H16N4O/c14-9-10-1-3-12(4-2-10)17-7-5-11(6-8-17)13(18)16-15/h1-4,11H,5-8,15H2,(H,16,18)
(3)InChIKey: RGOGBQRLKKDOHU-UHFFFAOYSA-N