ChemicalBook--->CAS DataBase List--->112-30-1

112-30-1

112-30-1 Structure

112-30-1 Structure
IdentificationMore
[Name]

Decyl alcohol
[CAS]

112-30-1
[Synonyms]

1-DECANOL
ALCOHOL C10
CAPRIC ALCOHOL
CAPRINALCOHOL
DECAN-1-OL
DECANOL
DECYL ALCOHOL
FEMA 2365
N-DECANOL
N-DECYL ALCOHOL
NONYLCARBINOL
1-decanol(decylalcohol)
1-hydroxydecane
Agent 504
agent504
Alfol 10
alfol10
Antak
C 10 ALCOHOL
c10alcohol
[EINECS(EC#)]

203-956-9
[Molecular Formula]

C10H22O
[MDL Number]

MFCD00004747
[Molecular Weight]

158.28
[MOL File]

112-30-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to slightly yellow liquid
[Melting point ]

5-7 °C (lit.)
[Boiling point ]

231 °C (lit.)
[density ]

0.829 g/mL at 25 °C(lit.)
[vapor density ]

4.5 (vs air)
[vapor pressure ]

1 mm Hg ( 70 °C)
[FEMA ]

2365
[refractive index ]

n20/D 1.437(lit.)
[Fp ]

180 °F
[storage temp. ]

Store below +30°C.
[solubility ]

ethanol: soluble60%, clear, colorless (1mL/3mL)
[form ]

Liquid
[pka]

15.21±0.10(Predicted)
[color ]

Clear colorless to slightly yellow
[Odor]

Faint alcoholic.
[explosive limit]

0.9-5.7%(V)
[Odor Threshold]

0.00077ppm
[Odor Type]

fatty
[Water Solubility ]

insoluble
[JECFA Number]

103
[Merck ]

14,2855
[BRN ]

1735221
[Dielectric constant]

8.1(20℃)
[InChIKey]

MWKFXSUHUHTGQN-UHFFFAOYSA-N
[LogP]

4.5 at 20℃
[Uses]

decyl alcohol can be used for any number of functions, including as an emollient, a foam-booster, a surfactant and a viscosity controller, as well to mask odor and as a fixative in perfumes. Decyl alcohol occurs naturally in sweet orange and ambrette seed. It is also derived commercially from liquid paraffin.
[CAS DataBase Reference]

112-30-1(CAS DataBase Reference)
[NIST Chemistry Reference]

1-Decanol(112-30-1)
[EPA Substance Registry System]

112-30-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xn,N,Xi
[Risk Statements ]

R20:Harmful by inhalation.
R36/37/38:Irritating to eyes, respiratory system and skin .
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R36/38:Irritating to eyes and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S37/39:Wear suitable gloves and eye/face protection .
S29:Do not empty into drains .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 3082 9/PG 3
[WGK Germany ]

1
[RTECS ]

HE4375000
[Autoignition Temperature]

550 °F
[TSCA ]

Yes
[HazardClass ]

9
[PackingGroup ]

III
[HS Code ]

29051900
[Safety Profile]

Moderately toxic by skin contact. Wdly toxic by ingestion and inhalation. A severe human skin and eye irritant. Experimental reproductive effects. Questionable carcinogen with experimental tumorigenic data. Combustible when exposed to heat or flame; can react with oxidzing materials. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and irritating fumes. See also ALCOHOLS.
[Hazardous Substances Data]

112-30-1(Hazardous Substances Data)
[Toxicity]

LD50 orally in Rabbit: 4720 mg/kg LD50 dermal Rabbit 3560 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Coconut oil-->1-Octadecanol-->1-Nonanol-->1-Nonanal-->1-NONENE-->AlcoholMixture-->Ethyl caprate-->N-Methylcapricamide-->9-Decenoic acid, methyl ester-->N,N-Dimethylcapramide
[Preparation Products]

Decyl aldehyde-->4-N-DECYLANILINE-->Didecyl phthalate-->FEMA 2368-->DECYL PROPIONATE-->N-DECYL ACETATE-->1-Undecanol, 3-methyl--->1-Dodecanol, 2-hexyl--->TRANS-2-DODECENOIC ACID-->Decyl methacrylate-->decyl cyanoacetate
Hazard InformationBack Directory
[General Description]

A clear colorless liquid with a sweet fat-like odor. Flash point 180°F. Less dense than water and insoluble in water. Vapors are heavier than air.
[Reactivity Profile]

DECYL ALCOHOL(112-30-1) attacks plastics. REF [Handling Chemicals Safely, 1980. p. 236]. Acetyl bromide reacts violently with alcohols or water, [Merck 11th ed., 1989]. Mixtures of alcohols with concentrated sulfuric acid and strong hydrogen peroxide can cause explosions. Example: An explosion will occur if dimethylbenzylcarbinol is added to 90% hydrogen peroxide then acidified with concentrated sulfuric acid. Mixtures of ethyl alcohol with concentrated hydrogen peroxide form powerful explosives. Mixtures of hydrogen peroxide and 1-phenyl-2-methyl propyl alcohol tend to explode if acidified with 70% sulfuric acid, [Chem. Eng. News 45(43):73(1967); J, Org. Chem. 28:1893(1963)]. Alkyl hypochlorites are violently explosive. They are readily obtained by reacting hypochlorous acid and alcohols either in aqueous solution or mixed aqueous-carbon tetrachloride solutions. Chlorine plus alcohols would similarly yield alkyl hypochlorites. They decompose in the cold and explode on exposure to sunlight or heat. Tertiary hypochlorites are less unstable than secondary or primary hypochlorites, [NFPA 491 M, 1991]. Base-catalysed reactions of isocyanates with alcohols should be carried out in inert solvents. Such reactions in the absence of solvents often occur with explosive violence, [Wischmeyer(1969)].
[Air & Water Reactions]

Insoluble in water.
[Health Hazard]

Direct contact can produce eye irritation; low general toxicity.
[Fire Hazard]

HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. Vapors may form explosive mixtures with air. Vapors may travel to source of ignition and flash back. Most vapors are heavier than air. They will spread along ground and collect in low or confined areas (sewers, basements, tanks). Vapor explosion hazard indoors, outdoors or in sewers. Runoff to sewer may create fire or explosion hazard. Containers may explode when heated. Many liquids are lighter than water.
[Chemical Properties]

1-Decanol has a floral odor resembling orange flowers and a slight, characteristic fatty taste.
[Chemical Properties]

clear colorless to slightly yellow liquid
[Chemical Properties]

The threshold odor concentration in air for decyl alcohol (isomer not specified) was reportedly 6.3 ppb.
[Occurrence]

Reported in the essential oils of ambrette seeds and almond flowers; also in citrus oils, fermented beverages, apple juice, bilberry, American cranberry, papaya, raspberry, cheeses, milk, butter, beef, pork, beer, cognac, whiskey, red, white and sparkling wines, coriander seeds and cardamom.
[Application]

decyl alcohol can be used for any number of functions, including as an emollient, a foam-booster, a surfactant and a viscosity controller, as well to mask odor and as a fixative in perfumes. Decyl alcohol occurs naturally in sweet orange and ambrette seed. It is also derived commercially from liquid paraffin.
[Definition]

ChEBI: A fatty alcohol consisting of a hydroxy function at C-1 of an unbranched saturated chain of ten carbon atoms.
[Preparation]

By sodium reduction or high-pressure catalytic hydrogenation of the esters of naturally occurring capric acid, or by oligomerization of ethylene using aluminium alkyl technology.
[Production Methods]

1-Decanol is prepared commercially by sodium reduction or by the high-pressure catalytic reduction of coconut oil, coconut fatty acids, or esters . It is also produced by the Ziegler process, which involves oxidation of trialkylaluminum compounds.
[Aroma threshold values]

Detection: 6 to 47 ppb
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 38, p. 3223, 1973 DOI: 10.1021/jo00958a031
Synthetic Communications, 12, p. 287, 1982 DOI: 10.1080/00397918209409235
[Chemical Reactivity]

Reactivity with Water No reaction; Reactivity with Common Materials: No reaction; Stability During Transport: Stable; Neutralizing Agents for Acids and Caustics: Not pertinent; Polymerization: Not pertinent; Inhibitor of Polymerization: Not pertinent.
[Synthesis]

Synthetically prepared from coconut oil derivatives; by reduction of some capric esters, such as methyl caprate.
[Carcinogenicity]

1-Decanol showed weak to moderate tumor-promoting activity when applied three times a week for 60 weeks to the skin of female Swiss mice that previously received an initiating dose of dimethylbenz[ a]anthracene .
[Metabolism]

See alcohol C-8.
[Purification Methods]

Fractionally distil n-decanol in an all-glass unit at 10mm pressure (b 110o), then fractionally crystallise by partial freezing. Also purify by preparative GLC, and by passage through alumina before use. [Beilstein 1 IV 1815.]
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1-Decanol(112-30-1).msds
Questions And AnswerBack Directory
[description]

1-Decanol, also known as decyl alcohol or n-decyl alcohol, is a straight chain fatty alcohol with ten carbon atoms and the molecular formula CH3(CH2)9OH. It is a colorless viscous liquid that is insoluble in water. It is colorless and has a strong odor. It is a clear colorless liquid with a sweet fat-like odor. It has a flash point of 180°F. It is less dense than water and insoluble in water. Its vapors are heavier than air.
[Applications]

Decyl alcohol can be used for the production of plasticizers, lubricants, surfactants and solvents. It is also used to study the thermal properties of polymer-monolithic stationary phases. Furthermore, it can used to enhance homomeric glycine receptor function. In addition to this, it is used in daily flavor, food flavor and cosmetics. In addition, the 5HT2α receptors were inhibited by the presence of decyl alcohol. This action has many psychological repercussions on an individual. It can also be used as a plant growth regulator of tobacco.
[Warning and Risk]

Decyl alcohol causes a high irritability to skin and eyes, when splashed into the eyes it can cause permanent damage. Also inhalation and ingestion can be harmful, it can also function as a narcotic. It is also harmful in the environment.
Spectrum DetailBack Directory
[Spectrum Detail]

Decyl alcohol(112-30-1)MS
Decyl alcohol(112-30-1)1HNMR
Decyl alcohol(112-30-1)13CNMR
Decyl alcohol(112-30-1)IR1
Decyl alcohol(112-30-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Decyl alcohol, 99%(112-30-1)
[Alfa Aesar]

1-Decanol, 98+%(112-30-1)
[Sigma Aldrich]

112-30-1(sigmaaldrich)
[TCI AMERICA]

1-Decanol,>97.0%(GC)(112-30-1)
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