(Iodomethyl)cyclohexane

Basic Information

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CAS Number

5469-33-0

Molecular Formula

C7H13I

Molecular Weight

224.08 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

213.3°C at 760 mmHg

SMILES

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C1CCC(CC1)CI

InChI

InChI=1S/C7H13I/c8-6-7-4-2-1-3-5-7/h7H,1-6H2

InChIKey

CXHHAWACKSPTFF-UHFFFAOYSA-N

LogP

3.0017000000000014

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

55.4

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

CS-0155327
5469-33-0
iodomethylcyclohexane
SY027725
Cyclohexane, (iodomethyl)-
(iodomethyl)cyclohexane
A870379
cyclohexylmethyl iodide
DTXSID70282275
AKOS014115901
SCHEMBL172670
EN300-7328452
AC1131
DS-5186
MFCD06410739
A1-03215
CXHHAWACKSPTFF-UHFFFAOYSA-N
FT-0716616
NSC-25316
(Iodomethyl )cyclohexane
NSC25316
(IODOMETHYL)CYCLOHEXANE
Iodomethylcyclohexane
(cyclohexyl)methyl iodide
cis-1,2-cyclohexanedimethyliodide
iodomethyl-cyclohexane
Jodmethyl-cyclohexan
C7H13I
4784AJ
AK126313

MDL Number

MFCD06410739

Customs Code

2903890090

FAQ

What are the physical and chemical properties of (Iodomethyl)cyclohexane (CAS: 5469-33-0)?

(Iodomethyl)cyclohexane is a colorless liquid with a molecular weight of approximately 154.01 g/mol. It has a melting point of -31°C, a boiling point of 122°C, and is slightly soluble in water but miscible with organic solvents. It is moderately reactive towards nucleophiles and can undergo substitution reactions.

How is (Iodomethyl)cyclohexane (CAS: 5469-33-0) typically synthesized?

(Iodomethyl)cyclohexane is usually synthesized by reacting cyclohexanone with hydrogen iodide in the presence of a suitable base such as potassium hydroxide. The reaction affords a good yield with high selectivity towards the formation of the desired iodomethyl group.

What industries use (Iodomethyl)cyclohexane (CAS: 5469-33-0)?

(Iodomethyl)cyclohexane is primarily used in the pharmaceutical industry for the synthesis of certain drug intermediates. It also finds applications in the polymer industry as a monomer for specific polymerization processes and in the production of certain sensors and semiconductors.

What precautions should be taken when handling (Iodomethyl)cyclohexane (CAS: 5469-33-0)?

When handling (Iodomethyl)cyclohexane, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Ensure proper ventilation by using a fume hood to avoid inhalation of fumes. Spills should be cleaned up immediately and in accordance with safety data sheet (SDS) guidelines. Store the compound in a cool, dry place away from sources of heat and ignition.