2,4-Dichloro-1,3,5-trifluorobenzene

C₆HCl₂F₃CAS 2368-53-8200.97 g/mol

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Properties

Molecular formula: C₆HCl₂F₃
Molar mass: 200.97 g/mol
Exact mass: 199.9407 Da
Density: 1.599 g/mL (at 20 °C)
Melting point: −11–10 °C
Boiling point: 161–162 °C
logP: 3.41Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

2368-53-8

SMILES

Fc1cc(F)c(Cl)c(F)c1Cl

InChIKey

UOGVNYNJSZHQCN-UHFFFAOYSA-N

InChI

InChI=1S/C6HCl2F3/c7-4-2(9)1-3(10)5(8)6(4)11/h1H

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Names and synonyms

3 names

Benzene, 2,4-dichloro-1,3,5-trifluoro-
1,3,5-Trifluoro-2,4-dichlorobenzene
1,3-Dichloro-2,4,6-trifluorobenzene

Work with 2,4-Dichloro-1,3,5-trifluorobenzene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,3,5-Trichloro-2,4,6-trifluorobenzene319-88-056 % similar 1,3-Dichloro-2,4-difluorobenzene36556-37-352 % similar 1,3-Dichloro-2,4,5,6-tetrafluorobenzene1198-61-450 % similar Pentafluorobenzene363-72-450 % similar 2,2′,3,3′,5,5′,6,6′-Octafluoro-1,1′-biphenyl3883-86-148 % similar Chloropentafluorobenzene344-07-045 % similar 1,2,4,5-Tetrafluorobenzene327-54-844 % similar 1,2-Dichloro-3-fluorobenzene36556-50-044 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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