6-Methyl-1-heptanol

Basic Information

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CAS Number

68526-83-0

Molecular Formula

C8H18O

Molecular Weight

130.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Melting Point

−76 °C

Boiling Point

183-186 °C

Density

0.833 g/mL at 25 °C

Flash Point

171 °F

Refractive Index

n20/D 1.431(lit.)

Vapor Pressure

0.2 mm Hg ( 20 °C)

SMILES

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CC(C)CCCCCO

InChI

InChI=1S/C8H18O/c1-8(2)6-4-3-5-7-9/h8-9H,3-7H2,1-2H3

InChIKey

BWDBEAQIHAEVLV-UHFFFAOYSA-N

LogP

2.1951000000000005

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

50.5

Safety Information

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Hazard Class

Class 9 Class 9

Synonyms & References

English

Z1198149583
EINECS 271-231-4
EINECS 271-361-1
Q27280756
FT-0671806
1653-40-3
AS-44335
METHYL HEPTANOL
MHN
EC 271-231-4
Titanium(4+) 6-methylheptan-1-olate
91994-92-2
EINECS 255-061-8
6-Methylheptanol (90per cent)
68551-09-7
1-Heptanol, 6-methyl-
EN300-219548
6-Methylheptanol (90%)
ISOOCTYL ALCOHOL
UNII-IJF7D6C38T
FT-0627438
MFCD00060842
CS-0210352
IJF7D6C38T
Isooctanol
6-METHYL-1-HEPTANOL
6-Methylheptanol
QSPL 119
SCHEMBL26877
NS00008167
6-methyl-heptan-1-ol

FAQ

What are the physical and chemical properties of 6-Methyl-1-heptanol (CAS: 68526-83-0)?

6-Methyl-1-heptanol (CAS: 68526-83-0) is a colorless liquid with a slightly sweet odor. It has a molecular weight of approximately 134.23 g/mol and a melting point of -55°C. The compound is moderately soluble in water but miscible with most organic solvents. It is relatively stable under normal conditions but can react with strong oxidizing agents.

How is 6-Methyl-1-heptanol (CAS: 68526-83-0) typically synthesized?

6-Methyl-1-heptanol is typically synthesized via reduction of 6-methyl-1-heptanone using a hydrogenation catalyst such as palladium on charcoal. The reaction is conducted under hydrogen pressure, and the product can be isolated by distillation with a yield of around 85-90%. The method is selective and provides a high purity product.

What industries use 6-Methyl-1-heptanol (CAS: 68526-83-0)?

6-Methyl-1-heptanol (CAS: 68526-83-0) is used in the pharmaceutical industry as a solvent and intermediate. It is also found in the polymer industry for synthesizing certain types of polymers. Additionally, it is used in the perfumery and fragrance industry as a flavoring agent. Its use in sensors and semiconductors is limited but is explored for specific applications.

What precautions should be taken when handling 6-Methyl-1-heptanol (CAS: 68526-83-0)?

When handling 6-Methyl-1-heptanol (CAS: 68526-83-0), safety goggles and gloves should be worn to protect against skin contact and inhalation. It is advisable to use a fume hood during operations to minimize exposure. In case of a spill, neutralize any acidic materials and dispose of the spill according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.