Structure

3-Chloro-4-fluoroiodobenzene

CAS
156150-67-3
Catalog Number
ACM156150673
Category
Aryl
Molecular Weight
256.44
Molecular Formula
C6H3ClFI

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Specification

Synonyms
2-chloro-1-fluoro-4-iodobenzene, 3-Chloro-4-fluoroiodobenzene, 156150-67-3, 2-Chloro4-iodofluorobenzene, 1-chloro-2-fluoro-5-iodobenzene, 3-chloro-4-fluoro-1-iodobenzene, 1-fluoro-2-chloro-4-iodobenzene, PubChem3433, ACMC-20an6s, SureCN80311, AC1MC5A2, AC1Q4MI1, 2-chloro-4-iodofluorobenzene, CTK4C8968, MolPort-000-153-015, ACT07755, Benzene,2-chloro-1-fluoro-4-iodo-, SBB101766, ZINC00152693, AKOS009156592
IUPAC Name
2-chloro-1-fluoro-4-iodobenzene
Canonical SMILES
C1=CC(=C(C=C1I)Cl)F
InChI Key
OMASDGWBVAVFQZ-UHFFFAOYSA-N
Boiling Point
94-95ºC15 mm Hg(lit.)
Flash Point
>230
Density
2.008 g/mL at 25ºC(lit.)
Appearance
Clear colourless to light yellow liquid
EC Number
605-045-5
Exact Mass
255.89500
Hazard Statements
H315-H319-H335
H-Bond Acceptor
1
H-Bond Donor
0
RIDADR
UN 2811 6.1 / PGIII
Safety Description
S26
Symbol
GHS07
WGK Germany
3
What is the molecular formula of 3-Chloro-4-fluoroiodobenzene?

The molecular formula of 3-Chloro-4-fluoroiodobenzene is C6H3ClFI.

What is the IUPAC name of 3-Chloro-4-fluoroiodobenzene?

The IUPAC name of 3-Chloro-4-fluoroiodobenzene is 2-chloro-1-fluoro-4-iodobenzene.

What is the InChIKey of 3-Chloro-4-fluoroiodobenzene?

The InChIKey of 3-Chloro-4-fluoroiodobenzene is OMASDGWBVAVFQZ-UHFFFAOYSA-N.

What is the molecular weight of 3-Chloro-4-fluoroiodobenzene?

The molecular weight of 3-Chloro-4-fluoroiodobenzene is 256.44 g/mol.

How many hydrogen bond acceptors does 3-Chloro-4-fluoroiodobenzene have?

3-Chloro-4-fluoroiodobenzene has 1 hydrogen bond acceptor.

What is the exact mass of 3-Chloro-4-fluoroiodobenzene?

The exact mass of 3-Chloro-4-fluoroiodobenzene is 255.89520 g/mol.

How many heavy atoms are present in 3-Chloro-4-fluoroiodobenzene?

There are 9 heavy atoms in 3-Chloro-4-fluoroiodobenzene.

Does 3-Chloro-4-fluoroiodobenzene have any defined atom stereocenters?

No, 3-Chloro-4-fluoroiodobenzene does not have any defined atom stereocenters.

What is the topological polar surface area of 3-Chloro-4-fluoroiodobenzene?

The topological polar surface area of 3-Chloro-4-fluoroiodobenzene is 0Ų.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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