2,6-Dichloro-benzotrifluoride

C₇H₃Cl₂F₃CAS 104359-35-5215.00 g/mol

Open in Covalent MOL file

Alkyl halide Aryl halide

Properties

Molecular formula: C₇H₃Cl₂F₃
Molar mass: 215.00 g/mol
Exact mass: 213.9564 Da
logP: 4.01Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

104359-35-5

SMILES

C1=CC(=C(C(=C1)Cl)C(F)(F)F)Cl

InChIKey

MKSYCGMWKMMQPN-UHFFFAOYSA-N

InChI

InChI=1S/C7H3Cl2F3/c8-4-2-1-3-5(9)6(4)7(10,11)12/h1-3H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

2,6-Dichlorobenzotrifluoride

Work with 2,6-Dichloro-benzotrifluoride

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Chlorobenzotrifluoride88-16-458 % similar 2-Chloro-6-(trifluoromethyl)benzenamine433-94-350 % similar 3,5-Bis(trifluoromethyl)benzene402-31-348 % similar 3,4,5-Trichlorobenzotrifluoride50594-82-646 % similar 1,2-Dichlorobenzene95-50-145 % similar 3-Chloro-4-fluorobenzotrifluoride78068-85-645 % similar 1-Chloro-4-fluoro-2-(trifluoromethyl)benzene89634-75-345 % similar 3,5-Dichloro-4-fluorobenzotrifluoride77227-81-744 % similar

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

Same formula

1,4-Dichloro-2-(trifluoromethyl)benzene320-50-3 2,4-Dichlorobenzotrifluoride320-60-5 3,4-Dichlorobenzotrifluoride328-84-7 1,2-Dichloro-3-(trifluoromethyl)benzene54773-19-2 1,3-Dichloro-5-(trifluoromethyl)benzene54773-20-5

Elsewhere

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