Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

Decanal

Related Products

Hot Products

Name

Decanal

EINECS 203-957-4
CAS No. 112-31-2 Density 0.818 g/cm3
PSA 17.07000 LogP 3.32600
Solubility insoluble in water Melting Point 7 °C
Formula C10H20O Boiling Point 209 °C at 760 mmHg
Molecular Weight 156.268 Flash Point 85.6 °C
Transport Information UN 3082 Appearance colourless liquid
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 112-31-2 (Decanal) Hazard Symbols IrritantXi
Synonyms

Decanaldehyde;Decyl aldehyde;Decylic aldehyde;NSC 6087;n-Decaldehyde;n-Decanal;n-Decylaldehyde;Capraldehyde;Capric aldehyde;Caprinaldehyde;Caprinic aldehyde;Decaldehyde;

Article Data 255

Decanal Synthetic route

112-30-1

1-Decanol

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With air; poly-alkylated (nitrosyl)Ru(salen) In benzene-d6 at 20℃; for 12h; Irradiation;100%
With air; 1-Phenylethanol; (nitrosyl)Ru(salen) In benzene-d6 at 20℃; for 24h; Product distribution; Further Variations:; Catalysts; Temperatures; Irradiation;100%
With 2,2,6,6-tetramethyl-piperidine-N-oxyl; oxygen; copper(I) bromide dimethylsulfide complex In chlorobenzene at 90℃; for 7h;100%
42196-81-6

2-nonyl-1,3-dithiane

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With tetrafluoroboric acid; mercury(II) oxide In tetrahydrofuran Ambient temperature;100%
With K-10 clay supported iron(III) nitrate nonahydrate In dichloromethane for 4h; Ambient temperature; with K-10 clay-supported copper(II) nitrate trihydrate;99.1%
With nitric acid; arsenic(III) trioxide In dichloromethane at 0 - 5℃;96%
With iodine; silver nitrate In tetrahydrofuran for 6h; Ambient temperature;88%
7779-41-1

1,1-dimethoxy decane

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With water In tetrahydrofuran; diethyl ether at 80℃; under 6000.6 Torr; Inert atmosphere; Autoclave;100%
With C11H10N2O2Pd(1+)*ClO4(1-); water In acetonitrile at 50℃; Reagent/catalyst; Temperature;96%
With polymer-supported dicyanoketene acetal; water In acetonitrile at 20℃; for 0.5h; Hydrolysis;17%
Multi-step reaction with 2 steps
1: 92 percent / CH2Cl2 / 0.5 h / 0 °C
2: 100 percent / PPTS; water / acetone / 2 h
View Scheme
34764-02-8

decanal diethyl acetal

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With water In tetrahydrofuran; diethyl ether at 80℃; under 6000.6 Torr; Inert atmosphere; Autoclave;100%
indium(III) chloride In methanol; water for 1.41667h; Heating;96%
Stage #1: decanal diethyl acetal With 2,4,6-trimethyl-pyridine; triethylsilyl trifluoromethyl sulfonate In dichloromethane at 0℃; for 2h;
Stage #2: With water In dichloromethane for 0.1h;
85%

1-(1-methoxydecyl)pyridinium trifluoromethanesulfonate

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With water; pyridinium p-toluenesulfonate In acetone for 2h;100%
764-93-2

1-decyne

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With C71H80N3P2Ru*F6P(1-); water In acetone at 60℃; for 18h; Inert atmosphere;99%
With benzo[1,3,2]dioxaborole In tetrahydrofuran for 12h; Heating; hydroboration of alkenes and alkynes; var. reaction partners;90%
With cyclopentadienylruthenium(II) trisacetonitrile hexafluorophosphate; 5,5′-bis(trifluoromethyl)-2,2′-bipyridine In 1-methyl-pyrrolidin-2-one; water at 25℃; for 24h; Inert atmosphere; Autoclave;90%
112-30-1

1-Decanol

A

112-31-2

caprinaldehyde

B

1654-86-0

decyl decanoate

Conditions
ConditionsYield
With silica gel; 4-acetylamino-2,2,6,6-tetramethylpiperidine-1-oxoammonium perchlorate In dichloromethaneA 99%
B n/a
With oxygen at 60℃; under 760.051 Torr; for 24h; Irradiation;A 6%
B 47%
With 4-(benzyloxycarbonyl)-2,2,6,6-tetramethylpiperidine-1-oxyl; sodium hydrogencarbonate; pyridinium hydrobromide perbromide In dichloromethane; water at 0 - 4℃;
With 4-acetylamino-2,2,6,6-tetramethyl-1-piperidinoxy; iodine; sodium hydrogencarbonate In dichloromethane; water at 20 - 22℃; for 3h;A 22 %Chromat.
B 16 %Chromat.
In hexane at 180℃; for 5h;A 7 %Chromat.
B 12 %Chromat.

decanoic acid Li-salt

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With 9-borabicyclo[3.3.1]nonane dimer In tetrahydrofuran for 1h; Ambient temperature;98%
334-48-5

1-decanoic acid

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With thexylchloroborane-Me2SO4 In dichloromethane for 0.25h; Ambient temperature;97%
With thexylbromoborane dimethyl sulfide complex In carbon disulfide; dichloromethane at -20 - 20℃; for 1h;94%
With 9-borabicyclo[3.3.1]nonane dimer; lithium dihydrido borata-bicyclo[3.3.0]nonane In tetrahydrofuran for 1h; Ambient temperature;92%
1797-17-7

1,1-decanediol diacetate

112-31-2

caprinaldehyde

Conditions
ConditionsYield
With tetra-N-butylammonium tribromide In methanol at 20℃; for 0.25h;97%
With sodium hydrogen sulfate; PEG-2000 at 70℃; for 0.583333h;88%
With iron(II) sulfate In toluene for 10h; Heating; Yield given;

Decanal Specification

This chemical has the systematic name Decanal. With the CAS registry number 112-31-2, its classification codes are Mutation data; Natural Product; Skin / Eye Irritant. It's an organic compound with the chemical formula C9H19CHO. It belongs to the product category Pharmaceutical Intermediates. However, it should be sealed in the cool and dry place, away from the oxides.

Other characteristics of the Decanal can be summarised as followings: (1)ACD/LogP: 4.09; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.09; (4)ACD/LogD (pH 7.4): 4.09; (5)ACD/BCF (pH 5.5): 761.52; (6)ACD/BCF (pH 7.4): 761.52; (7)ACD/KOC (pH 5.5): 4020.77; (8)ACD/KOC (pH 7.4): 4020.77; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.422; (14)Molar Refractivity: 48.56 cm3; (15)Molar Volume: 190.9 cm3; (16)Polarizability: 19.25×10-24cm3; (17)Surface Tension: 27.9 dyne/cm; (18)Density: 0.818 g/cm3; (19)Flash Point: 85.6 °C; (20)Enthalpy of Vaporization: 44.53 kJ/mol; (21)Boiling Point: 209 °C at 760 mmHg; (22)Vapour Pressure: 0.207 mmHg at 25°C.

Production method of the Decanal: It could be prepared by oxidation of the related alcohol decanol.

the Decanal could be prepared by oxidation of the related alcohol decanol.

Uses of the Decanal: It is used in fragrances and flavoring and it is an important component in citrus along with octanal, citral, and sinensal. Decanal is also an important component of buckwheat odour.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: O=CCCCCCCCCC
2.InChI: InChI=1/C10H20O/c1-2-3-4-5-6-7-8-9-10-11/h10H,2-9H2,1H3
3.InChIKey: KSMVZQYAVGTKIV-UHFFFAOYAQ

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 41750mg/kg (41750mg/kg) BEHAVIORAL: EXCITEMENT

GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"

SKIN AND APPENDAGES (SKIN): HAIR: OTHER
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.
rabbit LD50 skin 5040uL/kg (5.04mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.
rat LD50 oral 3730uL/kg (3.73mL/kg)   American Industrial Hygiene Association Journal. Vol. 23, Pg. 95, 1962.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 112-31-2