3-Methylhexane Structure

3-Methylhexane

Chemical Properties

Melting point −119 °C(lit.)
Boiling point 91 °C(lit.)
Density  0.687 g/mL at 25 °C(lit.)
vapor pressure  2.13 psi ( 37.7 °C)
refractive index  n20/D 1.388(lit.)
Flash point 25 °F
solubility  Soluble in acetone, alcohol, benzene, chloroform, ligroin, and ether (Weast, 1986). Miscible with liquid aliphatic hydrocarbons.
form  clear liquid
color  Colorless to Almost colorless
Odor Threshold 0.84ppm
explosive limit ~7%
Water Solubility  2.64mg/L(25 ºC)
Thermal Conductivity 0.1112 W/(m·K) at 25 ℃
BRN  1718739
Henry's Law Constant 2.38 at 25 °C (Mackay and Shiu, 1981)
Dielectric constant 1.9299999999999999
Exposure limits TLV-TWA: 200 ppm; TLV-STEL: 400 ppm
InChI 1S/C7H16/c1-4-6-7(3)5-2/h7H,4-6H2,1-3H3
InChIKey VLJXXKKOSFGPHI-UHFFFAOYSA-N
SMILES CCCC(C)CC
LogP 4.118 (est)
CAS DataBase Reference 589-34-4(CAS DataBase Reference)
FDA UNII 1J3ZK6L6VY
EPA Substance Registry System 3-Methylhexane (589-34-4)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Flame (GHS02)Exclamation Mark (GHS07)Health Hazard (GHS08)Environment (GHS09)
Signal wordDanger
Hazard statements H315-H336-H304-H410-H225
Precautionary statements P501-P273-P240-P261-P210-P233-P243-P241-P242-P271-P264-P280-P370+P378-P391-P331-P362+P364-P303+P361+P353-P332+P313-P301+P310-P304+P340+P312-P403+P233-P403+P235-P405
Hazard Codes  F,Xn,N
Risk Statements  11-38-50/53-65-67
Safety Statements  9-16-29-33-60-61-62
RIDADR  UN 1206 3/PG 2
WGK Germany  1
Autoignition Temperature 536 °F
TSCA  TSCA listed
HS Code  2901.10.5000
HazardClass  3.1
PackingGroup  II
Storage Class 3 - Flammable liquids
Hazard Classifications Aquatic Acute 1
Aquatic Chronic 1
Asp. Tox. 1
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3
NFPA 704:
3
0 0

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3-Methylhexane Chemical Properties,Usage,Production

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