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HomeProduct name list3-METHYLOCTANE

3-METHYLOCTANE

  • CAS NO.:2216-33-3
  • Empirical Formula: C9H20
  • Molecular Weight: 128.26
  • MDL number: MFCD00042906
  • EINECS: 218-686-7
  • SAFETY DATA SHEET (SDS)
  • Update Date: 2024-12-18 14:07:02
3-METHYLOCTANE Structural

What is 3-METHYLOCTANE?

The Uses of 3-METHYLOCTANE

3-Methyloctane is a volatile organic compounds in breath as markers of human lung cancer.

Synthesis Reference(s)

The Journal of Organic Chemistry, 49, p. 3928, 1984 DOI: 10.1021/jo00195a009

Purification Methods

Take it through a silica gel column and distil it. [Klassen & Ross J Phys Chem 91 3668 1987, Beilstein 1 IV 455]

Properties of 3-METHYLOCTANE

Melting point: -107.6°C
Boiling point: 144 °C
Density  0.72
refractive index  n20/D 1.407
Flash point: 32 °C
solubility  soluble in Ether,Benzene,Acetone
form  clear liquid
color  Colorless
Water Solubility  0.8mg/L(23 ºC)
Dielectric constant 30.0(21℃)
Stability: Volatile
CAS DataBase Reference 2216-33-3(CAS DataBase Reference)
EPA Substance Registry System Octane, 3-methyl- (2216-33-3)

Safety information for 3-METHYLOCTANE

Signal word Danger
Pictogram(s)
ghs
Flame
Flammables
GHS02
ghs
Health Hazard
GHS08
GHS Hazard Statements H226:Flammable liquids
H304:Aspiration hazard
Precautionary Statement Codes P210:Keep away from heat/sparks/open flames/hot surfaces. — No smoking.
P233:Keep container tightly closed.
P240:Ground/bond container and receiving equipment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.
P370+P378:In case of fire: Use … for extinction.
P405:Store locked up.
P403+P235:Store in a well-ventilated place. Keep cool.
P501:Dispose of contents/container to..…

Computed Descriptors for 3-METHYLOCTANE

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