Acetamide,N-[(4-chlorophenyl)methyl]-2-cyano- supplier

Name
N-(4-CHLOROBENZYL)-2-CYANOACETAMIDE
EINECS
CAS No. 66158-49-4
Article Data5
CAS DataBase
Density 1.252 g/cm³
Solubility
Melting Point 120-122 °C
Formula C₁₀H₉ClN₂O
Boiling Point 452.5 °C at 760 mmHg
Molecular Weight 208.647
Flash Point 227.5 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms Acetamide,N-p-chlorobenzyl-2-cyano- (6CI);
PSA 52.89000
LogP 2.26078

Acetamide,N-[(4-chlorophenyl)methyl]-2-cyano- Specification

The Acetamide,N-[(4-chlorophenyl)methyl]-2-cyano-, with the CAS registry number 66158-49-4, is also known as N-[(4-Chlorophenyl)methyl]-2-cyanoacetamide. This chemical's molecular formula is C₁₀H₉ClN₂O and molecular weight is 208.64. Its systematic name is called N-(4-chlorobenzyl)-2-cyanoacetamide. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Acetamide,N-[(4-chlorophenyl)methyl]-2-cyano-: (1)ACD/LogP: 0.80; (2)ACD/LogD (pH 5.5): 0.39; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 25.07; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.555; (11)Molar Refractivity: 53.5 cm³; (12)Molar Volume: 166.5 cm³; (13)Surface Tension: 49 dyne/cm; (14)Density: 1.252 g/cm³; (15)Flash Point: 227.5 °C; (16)Enthalpy of Vaporization: 71.17 kJ/mol; (17)Boiling Point: 452.5 °C at 760 mmHg; (18)Vapour Pressure: 2.23E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)CNC(=O)CC#N
(2)InChI: InChI=1/C10H9ClN2O/c11-9-3-1-8(2-4-9)7-13-10(14)5-6-12/h1-4H,5,7H2,(H,13,14)
(3)InChIKey: UKKHUKFEKBKULS-UHFFFAOYAR

Product Name

N-(4-CHLOROBENZYL)-2-CYANOACETAMIDE

Acetamide,N-[(4-chlorophenyl)methyl]-2-cyano- Specification

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