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Name |
2,4-Difluoro-3,5-dichloroaniline |
EINECS | N/A |
CAS No. | 83121-15-7 | Density | 1.596 g/cm3 |
PSA | 26.02000 | LogP | 3.43500 |
Solubility | N/A | Melting Point |
75 °C |
Formula | C6H3Cl2F2N | Boiling Point | 268.1 °C at 760 mmHg |
Molecular Weight | 197.999 | Flash Point | 116 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
3,5-Dichloro-2,4-difluoroaniline; |
Article Data | 2 |
The Benzenamine,3,5-dichloro-2,4-difluoro-, with CAS registry number 83121-15-7, has the systematic name of 3,5-dichloro-2,4-difluoroaniline. Besides this, it is also called 2,4-Difluoro-3,5-Dichloro aniline. And the chemical formula of this chemical is C6H3Cl2F2N.
Physical properties of Benzenamine,3,5-dichloro-2,4-difluoro-: (1)ACD/LogP: 3.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.57; (4)ACD/LogD (pH 7.4): 3.57; (5)ACD/BCF (pH 5.5): 304.21; (6)ACD/BCF (pH 7.4): 304.23; (7)ACD/KOC (pH 5.5): 2084.77; (8)ACD/KOC (pH 7.4): 2084.87; (9)#H bond acceptors: 1; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 40.26 cm3; (15)Molar Volume: 124 cm3; (16)Polarizability: 15.96×10-24cm3; (17)Surface Tension: 43.8 dyne/cm; (18)Enthalpy of Vaporization: 50.62 kJ/mol; (19)Vapour Pressure: 0.00784 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Benzenamine,3,5-dichloro-2,4-difluoro- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(c(F)c(Cl)c1F)N
(2)InChI: InChI=1/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2
(3)InChIKey: KLECNQGLBJHVSH-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C6H3Cl2F2N/c7-2-1-3(11)6(10)4(8)5(2)9/h1H,11H2
(5)Std. InChIKey: KLECNQGLBJHVSH-UHFFFAOYSA-N