1,16-Hexadecanediol

Basic Information

View in Editor

CAS Number

7735-42-4

Molecular Formula

C16H34O2

Molecular Weight

258.45 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

90.0 to 94.0 deg-C

Boiling Point

200°C/4mmHg

Density

0.8878 (rough estimate)

Refractive Index

1.4760 (estimate)

SMILES

View in Editor

C(CCCCCCCCO)CCCCCCCO

InChI

InChI=1S/C16H34O2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h17-18H,1-16H2

InChIKey

GJBXIPOYHVMPQJ-UHFFFAOYSA-N

LogP

4.432400000000005

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

121

Safety Information

View Safety Information

GHS Hazard Pictograms

H315

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

Synonyms & References

English

MFCD00002821
DTXSID7064788
1,16-Hexydecanediol
Z799LHM79S
1,16-Hexadecanediol, 97%
EINECS 231-794-9
SCHEMBL318857
T72930
CS-0158377
Hexadecane-1,16-diol
AS-57115
Hexadecamethylene glycol
A904674
UNII-Z799LHM79S
AKOS015856534
FT-0606055
QSPL 082
CHEBI:195244
1,16-Dihydroxyhexadecane
H0552
alpha,omega-hexadecanediol
23079-20-1
1,16-Hexadecanediol
SY051530
Urea, compounded with 1,16-hexadecanediol
7735-42-4
CHEMBL448715
C16H34O2
1,16-hexadecane-diol
AMY37896
NS00037911

MDL Number

MFCD00002821

FAQ

What are the physical and chemical properties of 1,16-Hexadecanediol (CAS: 7735-42-4)?

1,16-Hexadecanediol (CAS: 7735-42-4) is a colorless, crystalline solid with a molecular weight of approximately 260.43 g/mol. It has a high solubility in ethanol and acetone but is poorly soluble in water. It is relatively reactive towards acid-catalyzed esterification reactions. Its melting point is around 50°C and it is slightly soluble in water.

How is 1,16-Hexadecanediol (CAS: 7735-42-4) typically synthesized?

1,16-Hexadecanediol (CAS: 7735-42-4) is typically synthesized by reducing hexadecanone with a suitable reducing agent such as sodium borohydride. This process yields high selectivity and good yield. Catalysts like palladium on carbon can also be used for more efficient hydrogenation reactions.

What industries use 1,16-Hexadecanediol (CAS: 7735-42-4)?

1,16-Hexadecanediol (CAS: 7735-42-4) is used in the pharmaceutical industry for the synthesis of drugs, in the polymer industry for creating flexible plastics, in the sensor industry for producing chemical sensors, and in the semiconductor industry for creating protective coatings.

What precautions should be taken when handling 1,16-Hexadecanediol (CAS: 7735-42-4)?

When handling 1,16-Hexadecanediol (CAS: 7735-42-4), it is important to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. Store it in a cool, dry place away from heat sources. In case of a spill, use appropriate absorbent materials and follow local hazardous waste disposal regulations. Always refer to the SDS for specific safety guidelines.