1-Iodohexadecane

Basic Information

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CAS Number

544-77-4

Molecular Formula

C16H33I

Molecular Weight

352.34 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

21-23 °C

Boiling Point

207°C/9.8mmHg

Water Solubility

Insoluble in water.

Solubility

Insuluble (1.6E-5 g/L) (25 ºC),

Refractive Index

n20/D 1.4806(lit.)

SMILES

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CCCCCCCCCCCCCCCCI

InChI

InChI=1S/C16H33I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3

InChIKey

KMWHQYDMBYABKL-UHFFFAOYSA-N

LogP

6.9027000000000065

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

123

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Stability

Stable, but light sensitive. Incompatible with strong bases, strong oxidizing agents.

Sensitiveness

Light Sensitive

Synonyms & References

English

Tox21_202845
Cetyljodid
Cetyl iodide
AKOS006029121
FT-0607962
1-Iodohexadecane, contains copper as stabilizer, 95%
JO95X48M8O
n-Hexadecyl iodide
1-IODOHEXADECANE
1-Iodohexadecane contains copper as stabilizer
CAS-544-77-4
SCHEMBL562180
40474-98-4
MFCD00001089
DTXSID0049317
D91141
CS-0179397
Hexadecane, iodo-
1-iodo-hexadecane
CHEMBL1233571
Hexadecyl iodide
NCGC00260391-01
Q27281601
Hexadecane, 1-iodo-
UNII-JO95X48M8O
NS00033095
1-iodanylhexadecane
544-77-4
EINECS 208-879-4
A830208
I0408

MDL Number

MFCD00001089

Customs Code

2903399090

FAQ

What regulatory guidelines apply to 1-Iodohexadecane (CAS: 544-77-4)?

1-Iodohexadecane (CAS: 544-77-4) should comply with the Globally Harmonized System (GHS) for classification and labeling of chemicals, REACH regulations for EU-based manufacturers and importers, and the Toxic Substances Control Act (TSCA) and EPA regulations in the United States. Specific classification includes classification as a combustible liquid and skin, eye, and respiratory irritant. Compliance with local and regional regulations is also necessary.

Are there alternatives to 1-Iodohexadecane (CAS: 544-77-4) in synthesis?

Alternatives to 1-Iodohexadecane (CAS: 544-77-4) in synthesis include 1-iodododecane and 1-iodotetradecane. Common substitute reagents like iodine-containing alkyl halides can be used depending on the specific reaction conditions and desired product structure. It is important to evaluate the reactivity and solubility of these alternatives in the context of the synthesis process.

What is the market or research trend for 1-Iodohexadecane (CAS: 544-77-4)?

The market for 1-Iodohexadecane (CAS: 544-77-4) is currently stable, with increasing research interest in its use as a precursor for the preparation of functionalized surfactants and as a component in specialized chemical formulations. Recent studies are exploring its application in nanotechnology and as a biofilm inhibitor. Market trends indicate a growing demand in sectors such as pharmaceuticals and cosmetics.

How should waste containing 1-Iodohexadecane (CAS: 544-77-4) be handled?

Waste containing 1-Iodohexadecane (CAS: 544-77-4) should be collected in appropriate containers and stored in a closed and labeled manner until disposal. Safe disposal methods include incineration, professional waste disposal services, or chemical recycling. Environmental protection precautions include ensuring no contamination of water sources and adherence to local waste management regulations. Proper documentation of waste handling and disposal must be maintained for regulatory compliance.