Methanone,(2-nitrophenyl)-1-piperidinyl- supplier

Name
1-(2-Nitrobenzoyl)piperidine
EINECS
CAS No. 26163-44-0
Article Data2
CAS DataBase
Density 1.256 g/cm³
Solubility
Melting Point
Formula C₁₂H₁₄N₂O₃
Boiling Point 411.9 °C at 760 mmHg
Molecular Weight 234.25
Flash Point 202.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Piperidine,1-(2-nitrobenzoyl)-(9CI);Piperidine,1-(o-nitrobenzoyl)-(8CI);1-(2-Nitrobenzoyl)piperidine;1-(o-Nitrobenzoyl)piperidine;(2-Nitrophenyl)(piperidin-1-yl)methanone;
PSA 66.13000
LogP 2.68200

Methanone,(2-nitrophenyl)-1-piperidinyl- Specification

The CAS registry number of Methanone,(2-nitrophenyl)-1-piperidinyl- is 26163-44-0. The systematic name is (2-nitrophenyl)(piperidin-1-yl)methanone. In addition, the molecular formula is C₁₂H₁₄N₂O₃ and the molecular weight is 234.25. It should be stored in a cool and dry place.

Physical properties about Methanone,(2-nitrophenyl)-1-piperidinyl- are: (1)ACD/LogP: 0.94; (2)ACD/LogD (pH 5.5): 0.94; (3)ACD/LogD (pH 7.4): 0.94; (4)ACD/BCF (pH 5.5): 3.03; (5)ACD/BCF (pH 7.4): 3.03; (6)ACD/KOC (pH 5.5): 76.89; (7)ACD/KOC (pH 7.4): 76.89; (8)#H bond acceptors: 5 ; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 66.13 Å²; (11)Index of Refraction: 1.589; (12)Molar Refractivity: 62.81 cm³; (13)Molar Volume: 186.3 cm³; (14)Polarizability: 24.9 ×10^-24cm³; (15)Surface Tension: 53 dyne/cm; (16)Density: 1.256 g/cm³; (17)Flash Point: 202.9 °C; (18)Enthalpy of Vaporization: 66.44 kJ/mol; (19)Boiling Point: 411.9 °C at 760 mmHg; (20)Vapour Pressure: 5.4E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccccc1[N+]([O-])=O)N2CCCCC2
(2)InChI: InChI=1/C12H14N2O3/c15-12(13-8-4-1-5-9-13)10-6-2-3-7-11(10)14(16)17/h2-3,6-7H,1,4-5,8-9H2
(3)InChIKey: QFRDNSHELUDVAL-UHFFFAOYAY

Product Name

1-(2-Nitrobenzoyl)piperidine

Methanone,(2-nitrophenyl)-1-piperidinyl- Specification

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