2,3-Difluoro-6-nitrotoluene supplier

Name
2,3-DIFLUORO-6-NITROTOLUENE
EINECS 1592732-453-0
CAS No. 914348-35-9
Article Data1
CAS DataBase
Density 1.374g/cm³
Solubility
Melting Point
Formula C₇H₅F₂NO₂
Boiling Point 223.728 °C at 760 mmHg
Molecular Weight 173.119
Flash Point 97.176 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,3-Difluoro-6-nitrotoluene;1,2-Difluoro-3-methyl-4-nitro-benzene;
PSA 45.82000
LogP 2.70460

2,3-Difluoro-6-nitrotoluene Specification

The Benzene,1,2-difluoro-3-methyl-4-nitro-, with CAS registry number 914348-35-9, has the systematic name of 1,2-difluoro-3-methyl-4-nitro-benzene. And the chemical formula of this chemical is C₇H₅F₂NO_2.

Physical properties of Benzene,1,2-difluoro-3-methyl-4-nitro-: (1)ACD/LogP: 2.28; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.28; (4)ACD/LogD (pH 7.4): 2.28; (5)ACD/BCF (pH 5.5): 31.804; (6)ACD/BCF (pH 7.4): 31.804; (7)ACD/KOC (pH 5.5): 414.09; (8)ACD/KOC (pH 7.4): 414.09; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 45.82 Å²; (13)Index of Refraction: 1.509; (14)Molar Refractivity: 37.611 cm³; (15)Molar Volume: 125.97 cm³; (16)Polarizability: 14.91×10^-24cm³; (17)Surface Tension: 38.927 dyne/cm; (18)Enthalpy of Vaporization: 44.149 kJ/mol; (19)Vapour Pressure: 0.141 mmHg at 25°C.

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

Product Name

2,3-DIFLUORO-6-NITROTOLUENE

2,3-Difluoro-6-nitrotoluene Specification

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