-
Name
N1-(2,6-Difluoro-3-nitrophenyl)acetamide
- EINECS
- CAS No. 25892-08-4
- Article Data7
- CAS DataBase
- Density 1.513 g/cm3
- Solubility
- Melting Point 148 °C
- Formula C8H6F2N2O3
- Boiling Point 352.7 °C at 760 mmHg
- Molecular Weight 216.144
- Flash Point 167.1 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms N1-(2,6-DIFLUORO-3-NITROPHENYL)ACETAMIDE;N-(2,6-DIFLUORO-3-NITROPHENYL)ACETAMIDE;N-(2,6-Difluoro-3-nitrophenyl)acetaMid
- PSA 74.92000
- LogP 2.42760
N-(2,6-Difluoro-3-nitrophenyl)acetamide Specification
The N1-(2,6-Difluoro-3-nitrophenyl)acetamide, with the CAS registry number 25892-08-4, is also known as N-(2,6-Difluoro-3-nitrophenyl)acetamide. It belongs to the product categories of Phenyls & Phenyl-Het; Phenyls & Phenyl-Het. This chemical's molecular formula is C8H6F2N2O3 and molecular weight is 216.14. What's more, its systematic name is N-(2,6-Difluoro-3-nitrophenyl)acetamide.
Physical properties about N1-(2,6-Difluoro-3-nitrophenyl)acetamide are: (1)ACD/LogP: 0.64; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.64; (4)ACD/LogD (pH 7.4): 0.64; (5)ACD/BCF (pH 5.5): 1.79; (6)ACD/BCF (pH 7.4): 1.79; (7)ACD/KOC (pH 5.5): 52.8; (8)ACD/KOC (pH 7.4): 52.8; (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: 1.573; (14)Molar Refractivity: 47.05 cm3; (15)Molar Volume: 142.7 cm3; (16)Polarizability: 18.65×10-24cm3; (17)Surface Tension: 50.5 dyne/cm; (18)Density: 1.513 g/cm3; (19)Flash Point: 167.1 °C; (20)Enthalpy of Vaporization: 59.75 kJ/mol; (21)Boiling Point: 352.7 °C at 760 mmHg; (22)Vapour Pressure: 3.77E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(Nc1c(F)ccc(c1F)[N+]([O-])=O)C
(2) InChI: InChI=1/C8H6F2N2O3/c1-4(13)11-8-5(9)2-3-6(7(8)10)12(14)15/h2-3H,1H3,(H,11,13)
(3) InChIKey: QWZBLFXPSOQZRQ-UHFFFAOYAZ
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