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589-90-2

589-90-2 Structure

589-90-2 Structure
IdentificationMore
[Name]

1,4-DIMETHYLCYCLOHEXANE
[CAS]

589-90-2
[Synonyms]

1,4-DIMETHYLCYCLOHEXANE
CIS-TRANS-1,4-DIMETHYLCYCLOHEXANE
DIMETHYLCYCLOHEXANE
HEXAHYDRO-P-XYLENE
1,4-Dimethylcyclohexane(c,t)
1,4-Dimethylcyclohexane,c&t
1,4-dimethylcyclohexane,mixtureofcisandtrans
dimethylcyclohexanes
p-Dimethylcyclohexane
1,4-DIMETHYLCYCLOHEXANE, 99%, MIXTURE OF CIS AND TRANS
1,4-dimethylcyclohexane cis-trans mixture
1,4-DIMETHYLCYCLOHEXANE (CIS-AND TRANS-MIXTURE) 97+%
1,4-Dimethylcyclohexane (cis-and trans-mixture)
[EINECS(EC#)]

209-663-2
[Molecular Formula]

C8H16
[MDL Number]

MFCD00001508
[Molecular Weight]

112.21
[MOL File]

589-90-2.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless liquid
[Melting point ]

−87 °C(lit.)
[Boiling point ]

120 °C(lit.)
[density ]

0.773 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.426(lit.)
[Fp ]

60 °F
[form ]

clear liquid
[color ]

Colorless to Almost colorless
[Odor]

at 1.00?%?in?benzyl benzoate. petroleum
[Odor Threshold]

1.4ppm
[Water Solubility ]

3.84mg/L(25 ºC)
[InChI]

1S/C8H16/c1-7-3-5-8(2)6-4-7/h7-8H,3-6H2,1-2H3
[InChIKey]

QRMPKOFEUHIBNM-UHFFFAOYSA-N
[SMILES]

CC1CCC(C)CC1
[LogP]

4.234 (est)
[CAS DataBase Reference]

589-90-2(CAS DataBase Reference)
[EPA Substance Registry System]

Cyclohexane, 1,4-dimethyl- (589-90-2)
Safety DataBack Directory
[Hazard Codes ]

F,Xn,N
[Risk Statements ]

R11:Highly Flammable.
R38:Irritating to the skin.
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R65:Harmful: May cause lung damage if swallowed.
R67:Vapors may cause drowsiness and dizziness.
[Safety Statements ]

S9:Keep container in a well-ventilated place .
S16:Keep away from sources of ignition-No smoking .
S33:Take precautionary measures against static discharges .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S62:If swallowed, do not induce vomiting: seek medical advice immediately and show this container or label .
[RIDADR ]

UN 2263 3/PG 2
[WGK Germany ]

2
[HS Code ]

2902.19.0050
[HazardClass ]

3.1
[PackingGroup ]

II
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Aquatic Chronic 2
Asp. Tox. 1
Flam. Liq. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[General Description]

Clear colorless liquids with a petroleum-like odor. Flash point between 51-61°F. Less dense than water and insoluble in water. Vapors heavier than air.
[Reactivity Profile]

Saturated aliphatic hydrocarbons, such as DIMETHYLCYCLOHEXANE(589-90-2), may be incompatible with strong oxidizing agents like nitric acid. Charring of the hydrocarbon may occur followed by ignition of unreacted hydrocarbon and other nearby combustibles. In other settings, aliphatic saturated hydrocarbons are mostly unreactive. They are not affected by aqueous solutions of acids, alkalis, most oxidizing agents, and most reducing agents.
[Air & Water Reactions]

Highly flammable. Insoluble in water.
[Health Hazard]

Inhalation or contact with material may irritate or burn skin and eyes. Fire may produce irritating, corrosive and/or toxic gases. Vapors may cause dizziness or suffocation. Runoff from fire control or dilution water may cause pollution.
[Chemical Properties]

clear colorless liquid
[Uses]

1,4-Dimethylcyclohexane (mixture of cis and trans) has been used to study the absorption of ultrasonic waves that can be measured by a reverberation technique.
[Uses]

Dialkylcyclohexane is used as a solvent. Dimethyl- and diethylcyclohexane are used in catalytic reforming to produce C8 aromatic compounds.
[Definition]

ChEBI: 1,4-dimethylcyclohexane is a cycloalkane that is cyclohexane substituted by a methyl group at positions 1 and 4. It has a role as a human metabolite and a plant metabolite. It derives from a hydride of a cyclohexane.
[Purification Methods]

Free it from olefins by shaking with conc H2SO4, washing with water, drying and fractionally distilling it. [Haggis & Owen J Chem Soc 411 1953, Beilstein 5 III 102, 5 IV 122.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,4-dimethyl cyclohexane(589-90-2).msds
Spectrum DetailBack Directory
[Spectrum Detail]

1,4-DIMETHYLCYCLOHEXANE(589-90-2)MS
1,4-DIMETHYLCYCLOHEXANE(589-90-2)1HNMR
1,4-DIMETHYLCYCLOHEXANE(589-90-2)IR1
1,4-DIMETHYLCYCLOHEXANE(589-90-2)IR2
1,4-DIMETHYLCYCLOHEXANE(589-90-2)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

589-90-2(sigmaaldrich)
[TCI AMERICA]

1,4-Dimethylcyclohexane  (cis-and trans-mixture),>98.0%(GC)(589-90-2)
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