Butanamide,N-(2,3-dichlorophenyl)-3-oxo- supplier

Name
2,3-DICHLOROACETOACETANILIDE
EINECS
CAS No. 63896-87-7
Density 1.393 g/cm³
Solubility
Melting Point
Formula C₁₀H₉C_l2NO₂
Boiling Point 415.4 °C at 760 mmHg
Molecular Weight 246.093
Flash Point 205 °C
Transport Information
Appearance
Safety
Risk Codes 22
Molecular Structure
Hazard Symbols Xn
Synonyms 2',3'-Dichloroacetoacetanilide;2,3-Dichloroacetoacetanilide;
PSA 46.17000
LogP 2.98400

Butanamide,N-(2,3-dichlorophenyl)-3-oxo- Specification

The Butanamide,N-(2,3-dichlorophenyl)-3-oxo-, with the CAS registry number 63896-87-7, is also known as 2,3-Dichloroacetoacetanilide. This chemical's molecular formula is C₁₀H₉C_l2NO₂ and molecular weight is 246.09. What's more, both its IUPAC name and systematic name are the same which is called N-(2,3-Dichlorophenyl)-3-oxobutanamide.

Physical properties about Butanamide,N-(2,3-dichlorophenyl)-3-oxo- are: (1)ACD/LogP: 1.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.64; (4)ACD/LogD (pH 7.4): 1.63; (5)ACD/BCF (pH 5.5): 10.45; (6)ACD/BCF (pH 7.4): 10.24; (7)ACD/KOC (pH 5.5): 186.68; (8)ACD/KOC (pH 7.4): 182.86; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 37.38 Å²; (13)Index of Refraction: 1.59; (14)Molar Refractivity: 59.61 cm³; (15)Molar Volume: 176.5 cm³; (16)Polarizability: 23.63×10^-24cm³; (17)Surface Tension: 49.1 dyne/cm; (18)Density: 1.393 g/cm³; (19)Flash Point: 205 °C; (20)Enthalpy of Vaporization: 66.85 kJ/mol; (21)Boiling Point: 415.4 °C at 760 mmHg; (22)Vapour Pressure: 4.12E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1c(NC(=O)CC(=O)C)cccc1Cl
(2) InChI: InChI=1/C10H9Cl2NO2/c1-6(14)5-9(15)13-8-4-2-3-7(11)10(8)12/h2-4H,5H2,1H3,(H,13,15)
(3) InChIKey: FDTQHEASYFCFLI-UHFFFAOYAM

Product Name

2,3-DICHLOROACETOACETANILIDE

Butanamide,N-(2,3-dichlorophenyl)-3-oxo- Specification

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