1-Chloro-3-fluoro-2-iodobenzene

C₆H₃ClFICAS 127654-70-0256.44 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₆H₃ClFI
Molar mass: 256.44 g/mol
Exact mass: 255.8952 Da
logP: 3.08Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 0

Identifiers

CAS number

127654-70-0

SMILES

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

InChIKey

AZUUTAFMFQSXMA-UHFFFAOYSA-N

InChI

InChI=1S/C6H3ClFI/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.

Work with 1-Chloro-3-fluoro-2-iodobenzene

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

1,3-Difluoro-2-iodobenzene13697-89-768 % similar 1,3-Dichloro-2-iodobenzene19230-28-564 % similar 1-Chloro-2-fluorobenzene348-51-658 % similar 1,2-Dichloro-3-fluorobenzene36556-50-054 % similar 2-Chloro-6-fluorophenol2040-90-650 % similar 2-Chloro-6-fluoroaniline363-51-950 % similar 2-Chloro-6-fluorotoluene443-83-450 % similar 3-Chloro-2-iodoaniline70237-25-150 % similar

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

Same formula

2-Chloro-4-fluoro-1-iodobenzene101335-11-9 2-Chloro-1-fluoro-4-iodobenzene156150-67-3 1-Chloro-2-fluoro-4-iodobenzene202982-67-0 1-Chloro-4-fluoro-2-iodobenzene202982-68-1 4-Chloro-2-fluoro-1-iodobenzene6797-79-1 1-Chloro-2-fluoro-3-iodobenzene72373-82-1

Elsewhere

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