chempirical

1,3-Dichloro-2-fluorobenzene

C6H3Cl2FCAS 2268-05-5164.99 g/mol

Open in Covalent MOL file
FClCl
Aryl halide

Properties

Molecular formula
C6H3Cl2F
Molar mass
164.99 g/mol
Exact mass
163.9596 Da
Melting point
35 °C
Boiling point
168–169 °C
logP
3.13Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
2268-05-5
SMILES
Fc1c(Cl)cccc1Cl
InChIKey
JORVCRLRRRRLFI-UHFFFAOYSA-N
InChI
InChI=1S/C6H3Cl2F/c7-4-2-1-3-5(8)6(4)9/h1-3H

Weigh it out

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

Names and synonyms

5 names
  • Benzene, 1,3-dichloro-2-fluoro-
  • 2,6-Dichlorofluorobenzene
  • 1-Fluoro-2,6-dichlorobenzene
  • 2-Fluoro-1,3-dichlorobenzene
  • 2,6-Dichloro-1-fluorobenzene

Work with 1,3-Dichloro-2-fluorobenzene

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

3-Chloro-2-fluorobenzenamine2106-04-964 % similar 1-Chloro-2-fluoro-3-iodobenzene72373-82-164 % similar 1-Chloro-2-fluoro-3-methylbenzene85089-31-264 % similar 1,3-Dichloro-2,5-difluorobenzene2367-80-860 % similar 3-Chloro-2-fluorobenzenemethanamine72235-55-356 % similar 3-Chloro-2-fluorobenzaldehyde85070-48-056 % similar 3-Chloro-2-fluorobenzonitrile94087-40-856 % similar 5-Bromo-1,3-dichloro-2-fluorobenzene17318-08-055 % similar

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

Same formula

1,3-Dichloro-5-fluorobenzene1435-46-7 2,4-Dichlorofluorobenzene1435-48-9 1,2-Dichloro-4-fluorobenzene1435-49-0 1,2-Dichloro-3-fluorobenzene36556-50-0

Elsewhere

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