1,3-Difluoro-2-methyl-4-nitrobenzene supplier

Name
1,3-difluoro-2-methyl-4-nitrobenzene
EINECS
CAS No. 79562-49-5
Article Data7
CAS DataBase
Density 1.374 g/cm³
Solubility Slightly soluble in water.
Melting Point
Formula C₇H₅F₂NO₂
Boiling Point 237.2 °C at 760 mmHg
Molecular Weight 173.119
Flash Point 108.8 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,3-difluoro-2-methyl-4-nitro-benzene
PSA 45.82000
LogP 2.70460

1,3-Difluoro-2-methyl-4-nitrobenzene Specification

The 1,3-Difluoro-2-methyl-4-nitrobenzene is an organic compound with the formula C₇H₅F₂NO₂. The systematic name of this chemical is 1,3-difluoro-2-methyl-4-nitro-benzene. With the CAS registry number 79562-49-5, it is also named as benzene, 1,3-difluoro-2-methyl-4-nitro-.

Physical properties about 1,3-Difluoro-2-methyl-4-nitrobenzene are: (1)ACD/LogP: 2.04; (2)ACD/LogD (pH 5.5): 2.04; (3)ACD/LogD (pH 7.4): 2.04; (4)ACD/BCF (pH 5.5): 20.89; (5)ACD/BCF (pH 7.4): 20.89; (6)ACD/KOC (pH 5.5): 306.47; (7)ACD/KOC (pH 7.4): 306.47; (8)#H bond acceptors: 3; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 45.82 Å²; (11)Index of Refraction: 1.508; (12)Molar Refractivity: 37.61 cm³; (13)Molar Volume: 125.9 cm³; (14)Polarizability: 14.91×10^-24cm³; (15)Surface Tension: 38.9 dyne/cm; (16)Density: 1.374 g/cm³; (17)Flash Point: 108.8 °C; (18)Enthalpy of Vaporization: 45.48 kJ/mol; (19)Boiling Point: 237.2 °C at 760 mmHg; (20)Vapour Pressure: 0.07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1c(ccc(c1F)N(=O)=O)F
(2)InChI: InChI=1/C7H5F2NO2/c1-4-5(8)2-3-6(7(4)9)10(11)12/h2-3H,1H3
(3)InChIKey: AVWNNVJXXMKAPB-UHFFFAOYAK
(4)Std. InChI: InChI=1S/C7H5F2NO2/c1-4-5(8)2-3-6(7(4)9)10(11)12/h2-3H,1H3
(5)Std. InChIKey: AVWNNVJXXMKAPB-UHFFFAOYSA-N

Product Name

1,3-difluoro-2-methyl-4-nitrobenzene

1,3-Difluoro-2-methyl-4-nitrobenzene Specification

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