Acetamide,N-(2,5-dimethyl-4-nitrophenyl)- supplier

Name
2,5-DIMETHYL-4-NITRO ACETANILIDE
EINECS
CAS No. 6954-69-4
Article Data14
CAS DataBase
Density 1.247 g/cm³
Solubility
Melting Point 171-171.5℃ (benzene chloroform )
Formula C₁₀H₁₂N₂O₃
Boiling Point 381.2 °C at 760 mmHg
Molecular Weight 208.217
Flash Point 184.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2',5'-Acetoxylidide,4'-nitro- (6CI);NSC 67711;N-(2,5-dimethyl-4-nitrophenyl)acetamide;Acetamide, N-(2,5-dimethyl-4-nitrophenyl)-;
PSA 74.92000
LogP 2.76620

Acetamide,N-(2,5-dimethyl-4-nitrophenyl)- Specification

The Acetamide,N-(2,5-dimethyl-4-nitrophenyl)-, with the CAS registry number 6954-69-4, has the systematic name of N-(2,5-dimethyl-4-nitrophenyl)acetamide. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₁₀H₁₂N₂O₃.

The characteristics of Acetamide,N-(2,5-dimethyl-4-nitrophenyl)- are as followings: (1)ACD/LogP: 2.58; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.58; (4)ACD/LogD (pH 7.4): 2.58; (5)ACD/BCF (pH 5.5): 53.82; (6)ACD/BCF (pH 7.4): 53.82; (7)ACD/KOC (pH 5.5): 603.4; (8)ACD/KOC (pH 7.4): 603.4; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 66.13 Å²; (13)Index of Refraction: 1.595; (14)Molar Refractivity: 56.72 cm³; (15)Molar Volume: 166.9 cm³; (16)Polarizability: 22.48×10^-24cm³; (17)Surface Tension: 49 dyne/cm; (18)Density: 1.247 g/cm³; (19)Flash Point: 184.4 °C; (20)Enthalpy of Vaporization: 62.95 kJ/mol; (21)Boiling Point: 381.2 °C at 760 mmHg; (22)Vapour Pressure: 5.15E-06 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [O-][N+](=O)c1cc(c(NC(=O)C)cc1C)C
(2)InChI: InChI=1/C10H12N2O3/c1-6-5-10(12(14)15)7(2)4-9(6)11-8(3)13/h4-5H,1-3H3,(H,11,13)
(3)InChIKey: IPRXWEPMOALPTO-UHFFFAOYAQ

Product Name

2,5-DIMETHYL-4-NITRO ACETANILIDE

Acetamide,N-(2,5-dimethyl-4-nitrophenyl)- Specification

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