Product Name

  • Name

    Decanal

  • EINECS 203-957-4
  • CAS No. 112-31-2
  • Article Data255
  • CAS DataBase
  • Density 0.818 g/cm3
  • 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;
  • PSA 17.07000
  • LogP 3.32600

Synthetic route

1-Decanol
112-30-1

1-Decanol

caprinaldehyde
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%
2-nonyl-1,3-dithiane
42196-81-6

2-nonyl-1,3-dithiane

caprinaldehyde
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%
1,1-dimethoxy decane
7779-41-1

1,1-dimethoxy decane

caprinaldehyde
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
decanal diethyl acetal
34764-02-8

decanal diethyl acetal

caprinaldehyde
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

1-(1-methoxydecyl)pyridinium trifluoromethanesulfonate

caprinaldehyde
112-31-2

caprinaldehyde

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

1-decyne

caprinaldehyde
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%
1-Decanol
112-30-1

1-Decanol

A

caprinaldehyde
112-31-2

caprinaldehyde

B

decyl decanoate
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

decanoic acid Li-salt

caprinaldehyde
112-31-2

caprinaldehyde

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

1-decanoic acid

caprinaldehyde
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%
1,1-decanediol diacetate
1797-17-7

1,1-decanediol diacetate

caprinaldehyde
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;
decyl chloride
1002-69-3

decyl chloride

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With trimethylamine-N-oxide In dimethyl sulfoxide for 24h; Ambient temperature;95%
methoxyethoxymethyl ether of (E)-1-trimethylsilyl-1-tridecen-4-ol

methoxyethoxymethyl ether of (E)-1-trimethylsilyl-1-tridecen-4-ol

A

caprinaldehyde
112-31-2

caprinaldehyde

B

6-nonyl-5,6-dihydro-2H-pyran

6-nonyl-5,6-dihydro-2H-pyran

Conditions
ConditionsYield
With titanium tetrachloride In dichloromethane at -78℃; Yields of byproduct given;A n/a
B 95%
2-n-nonyl-1,3-dioxolane
4353-06-4

2-n-nonyl-1,3-dioxolane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With iron(III) chloride In dichloromethane for 1h; Product distribution; Ambient temperature; other solvent, temperature;95%
indium(III) chloride In methanol; water for 1.41667h; Heating;86%
With 2,6-dimethylpyridine; trimethylsilyl trifluoromethanesulfonate In dichloromethane at 0℃; for 0.5h;79%
n-decanal oxime
13372-74-2

n-decanal oxime

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With γ-picolinium chlorochromate In dichloromethane at 20℃; for 4h;95%
With potassium permanganate; montmorillonite K-10 for 0.833333h;93%
With γ-picolinium chlorochromate; silica gel In dichloromethane at 20℃; for 8h;91%
4-(4-Methoxy-phenyl)-2-nonyl-[1,3]dioxolane
154410-50-1

4-(4-Methoxy-phenyl)-2-nonyl-[1,3]dioxolane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With 2,3-dicyano-5,6-dichloro-p-benzoquinone In dichloromethane; water Ambient temperature;94%
2-Nonyl-benzo[1,3]oxathiole
77863-77-5

2-Nonyl-benzo[1,3]oxathiole

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With tetrafluoroboric acid; mercury(II) oxide In tetrahydrofuran Ambient temperature;92%
With tetrafluoroboric acid; mercury(II) oxide In tetrahydrofuran Product distribution; Ambient temperature; various 1,3-benzoxathioles;92%
2-nonyl-1,3-oxathiolane
69895-04-1

2-nonyl-1,3-oxathiolane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With perchloric acid; dihydrogen peroxide; ammonium bromide; molybdic acid In dichloromethane at 0 - 5℃; for 1.5h;90%
With Glyoxilic acid; Amberlyst 15 at 80℃; for 3h;80%
α,α,α-trifluorotoluene
98-08-8

α,α,α-trifluorotoluene

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With potassium carbonate90%
1,2-Epoxydecane
2404-44-6

1,2-Epoxydecane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With 2,6-dimethylpyridine; trimethylsilyl trifluoromethanesulfonate In benzene at 80℃; for 10h;89%
methanol
67-56-1

methanol

1-decenyl dimethyl phosphate
74532-26-6, 74532-27-7

1-decenyl dimethyl phosphate

A

trimethyl phosphite
512-56-1

trimethyl phosphite

B

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With cesium fluoride at 65℃; for 22h;A 67%
B 88%
1-decenyl dimethyl phosphate
74532-26-6, 74532-27-7

1-decenyl dimethyl phosphate

A

trimethyl phosphite
512-56-1

trimethyl phosphite

B

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With methanol; cesium fluoride at 65℃; for 22h;A 67%
B 88%
sodium decanoate
1002-62-6

sodium decanoate

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With 9-borabicyclo[3.3.1]nonane dimer In tetrahydrofuran for 1h; Ambient temperature;88%
1,1-Bis-ethylsulfanyl-decane
69895-01-8

1,1-Bis-ethylsulfanyl-decane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With K-10 clay supported copper(II) nitrate trihydrate In dichloromethane for 3h; Ambient temperature; with K-10 clay-supported iron(III) nitrate nonahydrate;87.5%
With K-10 clay supported copper(II) nitrate trihydrate In dichloromethane for 3h; Ambient temperature; K-10 clay supported iron(III) nitrate nonahydrate;87.5%
1-Bromononane
693-58-3

1-Bromononane

carbon monoxide
201230-82-2

carbon monoxide

A

caprinaldehyde
112-31-2

caprinaldehyde

B

nonane
111-84-2

nonane

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile); α,α,α-trifluorotoluene; tri-n-butyl-tin hydride at 80℃; under 60800 Torr; for 2h;A 87%
B 8%
N,N-diethyldecanamide
2602-61-1

N,N-diethyldecanamide

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With zirconocene dichloride; lithium tri-t-butoxyaluminum hydride In tetrahydrofuran at 20℃; for 0.0333333h; Inert atmosphere;87%
Multi-step reaction with 2 steps
1: Ti(O-i-Pr)4, Ph2SiH2 / 20 °C
2: 1 M aq. HCl / tetrahydrofuran / 20 °C
View Scheme
1-bromo dodecane
112-29-8

1-bromo dodecane

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With dimethyl sulfoxide for 0.0666667h; Kornblum oxidation; Microwave irradiation;85%
With trimethylamine-N-oxide In dimethyl sulfoxide for 5h; Ambient temperature;81%
With 4-methylmorpholine N-oxide; 1-ethyl-3-methyl-1H-imidazol-3-ium chloride; potassium iodide at 100℃; for 0.0833333h; Microwave irradiation; Ionic liquid;80%
1-(Decanoyl-methyl-amino)-3-methyl-3H-imidazol-1-ium; iodide

1-(Decanoyl-methyl-amino)-3-methyl-3H-imidazol-1-ium; iodide

A

caprinaldehyde
112-31-2

caprinaldehyde

B

3-methyl-1-methylamino-3H-imidazol-1-ium iodide

3-methyl-1-methylamino-3H-imidazol-1-ium iodide

Conditions
ConditionsYield
With diisobutylaluminium hydride In tetrahydrofuran at -10 - 20℃; for 0.5h;A 83%
B n/a
C17H38O2Si

C17H38O2Si

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With hydrogenchloride In tetrahydrofuran; water at 30℃; for 4h;83%
3,4,4-Trimethyl-2-nonyl-oxazolidine
114246-23-0

3,4,4-Trimethyl-2-nonyl-oxazolidine

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With oxonium82%
1-(dimethylphenylsilyl)decan-1-ol
125828-06-0

1-(dimethylphenylsilyl)decan-1-ol

caprinaldehyde
112-31-2

caprinaldehyde

Conditions
ConditionsYield
With chromium(VI) oxide In dimethyl sulfoxide at 25℃;82%
caprinaldehyde
112-31-2

caprinaldehyde

1-decanoic acid
334-48-5

1-decanoic acid

Conditions
ConditionsYield
With selenium(IV) oxide; dihydrogen peroxide In tetrahydrofuran for 4h; Heating;100%
With palladium 10% on activated carbon; water; sodium hydroxide at 80℃; under 600.06 Torr; for 6h;99%
With dihydrogen peroxide In acetic acid at 90℃; for 7h;97%
caprinaldehyde
112-31-2

caprinaldehyde

Triphenylmethanesulfenamide
38499-08-0

Triphenylmethanesulfenamide

C29H35NS
86864-25-7

C29H35NS

Conditions
ConditionsYield
With pyridinium p-toluenesulfonate; magnesium sulfate In dichloromethane for 2h; Ambient temperature;100%
caprinaldehyde
112-31-2

caprinaldehyde

allyl-trimethyl-silane
762-72-1

allyl-trimethyl-silane

(3R,4R)-3-Trimethylsilanyl-tridec-1-en-4-ol

(3R,4R)-3-Trimethylsilanyl-tridec-1-en-4-ol

Conditions
ConditionsYield
With N,N,N,N,N,N-hexamethylphosphoric triamide; Bu3SnCl-BF3; tert.-butyl lithium In tetrahydrofuran -78 deg C to r.t.;100%
caprinaldehyde
112-31-2

caprinaldehyde

(methoxymethoxy)methane-1,1-dicarbonitrile

(methoxymethoxy)methane-1,1-dicarbonitrile

2-(1-hydroxy-decyl)-2-methoxymethoxy-malononitrile

2-(1-hydroxy-decyl)-2-methoxymethoxy-malononitrile

Conditions
ConditionsYield
With pyridine In dichloromethane at 20℃; for 5h; Addition;100%
caprinaldehyde
112-31-2

caprinaldehyde

decanoyl azide
157071-26-6

decanoyl azide

Conditions
ConditionsYield
With sodium azide; Iodine monochloride In acetonitrile at 25℃; for 2.5h;100%
caprinaldehyde
112-31-2

caprinaldehyde

n-decanal hydrazone
850532-89-7

n-decanal hydrazone

Conditions
ConditionsYield
With hydrazine hydrate at 100℃;100%
caprinaldehyde
112-31-2

caprinaldehyde

(S)-2-amino-3-phenylpropionamide hydrochloride
65864-22-4

(S)-2-amino-3-phenylpropionamide hydrochloride

(5S)-5-benzyl-2-nonylimidazolidin-4-one
1084907-57-2

(5S)-5-benzyl-2-nonylimidazolidin-4-one

Conditions
ConditionsYield
With potassium carbonate; triethylamine In ethanol at 60℃; for 24h;100%
caprinaldehyde
112-31-2

caprinaldehyde

tert-butyl 1-(2-methylallyl)hydrazinecarboxylate
1005794-49-9

tert-butyl 1-(2-methylallyl)hydrazinecarboxylate

tert-butyl 2-decylidene-1-(2-methylallyl)hydrazinecarboxylate
1226754-69-3

tert-butyl 2-decylidene-1-(2-methylallyl)hydrazinecarboxylate

Conditions
ConditionsYield
In ethanol at 20℃; for 24h; Inert atmosphere;100%
caprinaldehyde
112-31-2

caprinaldehyde

ethyl 2-cyanoacetate
105-56-6

ethyl 2-cyanoacetate

ethyl 2-amino-5-octylthiophene-3-carboxylate
1498335-42-4

ethyl 2-amino-5-octylthiophene-3-carboxylate

Conditions
ConditionsYield
With sulfur; triethylamine In ethanol at 60℃; Inert atmosphere;100%
With sulfur; triethylamine In ethanol Inert atmosphere;
caprinaldehyde
112-31-2

caprinaldehyde

4-Fluorothiophenol
371-42-6

4-Fluorothiophenol

decan-1,1-diylbis((4-fluorophenyl)sulfane)

decan-1,1-diylbis((4-fluorophenyl)sulfane)

Conditions
ConditionsYield
With toluene-4-sulfonic acid In toluene at 120℃; for 15h; Inert atmosphere; Schlenk technique;100%
caprinaldehyde
112-31-2

caprinaldehyde

thiophenol
108-98-5

thiophenol

decan-1,1-diylbis(phenylsulfane)

decan-1,1-diylbis(phenylsulfane)

Conditions
ConditionsYield
With toluene-4-sulfonic acid In toluene at 120℃; for 15h; Inert atmosphere; Schlenk technique;100%
caprinaldehyde
112-31-2

caprinaldehyde

methanesulfonic acid
75-75-2

methanesulfonic acid

C11H21O3S(1-)*Na(1+)

C11H21O3S(1-)*Na(1+)

Conditions
ConditionsYield
With sodium butanolate In butan-1-ol Reflux;100%
caprinaldehyde
112-31-2

caprinaldehyde

1-Decanol
112-30-1

1-Decanol

Conditions
ConditionsYield
With C43H42N2O4P2Ru; hydrogen In isopropyl alcohol at 100℃; under 22801.5 Torr; for 24h; Pressure; Glovebox; Autoclave;99%
antimony(III) chloride; aluminium In water; N,N-dimethyl-formamide for 3h; Ambient temperature;98%
With water; antimony(III) chloride; aluminium In N,N-dimethyl-formamide for 3h; Ambient temperature;98%
caprinaldehyde
112-31-2

caprinaldehyde

1,4-dibromo-2-(bromomethyl)but-2-ene
83889-55-8

1,4-dibromo-2-(bromomethyl)but-2-ene

3-Methylene-tetradec-1-en-5-ol

3-Methylene-tetradec-1-en-5-ol

Conditions
ConditionsYield
With zinc In N,N-dimethyl-formamide at 0℃; for 2h;99%
With zinc In tetrahydrofuran 1.) reflux, 2 h; 2.) room. temp., 2 h;87%
caprinaldehyde
112-31-2

caprinaldehyde

allylmagnesium bromide
1730-25-2

allylmagnesium bromide

1-tridecen-4-ol
117951-87-8

1-tridecen-4-ol

Conditions
ConditionsYield
In diethyl ether at -42 - 20℃; for 2h;99%
In tetrahydrofuran for 4h;33%
With water 1) Et2O, 0 deg C to r.t., 2 h; Yield given. Multistep reaction;
caprinaldehyde
112-31-2

caprinaldehyde

ethane-1,2-dithiol
540-63-6

ethane-1,2-dithiol

2-nonyl-1,3-dithiolane
131195-53-4

2-nonyl-1,3-dithiolane

Conditions
ConditionsYield
With toluene-4-sulfonic acid In acetic acid for 1h; Ambient temperature;99%
With PPA; silica gel In 1,2-dichloro-ethane at 20℃; for 0.5h;95%
With tetrabutylammomium bromide at 90 - 100℃; for 3.7h;91%
caprinaldehyde
112-31-2

caprinaldehyde

Methyl diethylphosphonoacetate
1067-74-9

Methyl diethylphosphonoacetate

methyl (E)-dodec-2-enolate
6208-91-9

methyl (E)-dodec-2-enolate

Conditions
ConditionsYield
With sodium hydride In tetrahydrofuran at -78 - 25℃; Condensation; Wadsworth-Emmons reaction;99%
caprinaldehyde
112-31-2

caprinaldehyde

Ethyl bromodifluoroacetate
667-27-6

Ethyl bromodifluoroacetate

2,2-difluoro-3-hydroxydodecanoic acid ethyl ester
172941-62-7

2,2-difluoro-3-hydroxydodecanoic acid ethyl ester

Conditions
ConditionsYield
With zinc In tetrahydrofuran at 20℃; for 3h;99%
With zinc In tetrahydrofuran Condensation; Heating;56%
With chloro-trimethyl-silane; ethylene dibromide; zinc In tetrahydrofuran53%
With zinc In tetrahydrofuran Condensation; Reformatsky reaction;46%
caprinaldehyde
112-31-2

caprinaldehyde

2-hydroxyethanethiol
60-24-2

2-hydroxyethanethiol

2-nonyl-1,3-oxathiolane
69895-04-1

2-nonyl-1,3-oxathiolane

Conditions
ConditionsYield
With PPA; silica gel In 1,2-dichloro-ethane at 20℃; for 0.5h;99%
polyaniline sulphate salt In dichloromethane at 20℃; for 6h;65%
With perchloric acid In dichloromethane at 0 - 5℃; for 2h;57%
n-butyl magnesium bromide
693-03-8

n-butyl magnesium bromide

caprinaldehyde
112-31-2

caprinaldehyde

3-methyl-1-tridecen-4-ol
87963-66-4

3-methyl-1-tridecen-4-ol

Conditions
ConditionsYield
Stage #1: n-butyl magnesium bromide With zirconocene dichloride In tetrahydrofuran; toluene at 0℃; for 0.5h;
Stage #2: With 2,4-dimethylpentan-3-one In tetrahydrofuran; toluene at 0℃; for 3h;
Stage #3: caprinaldehyde In tetrahydrofuran; toluene at 25℃; for 5h;
99%
caprinaldehyde
112-31-2

caprinaldehyde

3-trimethylsilyl-2-diethylphosphonopropionic acid ethyl ester
110481-61-3

3-trimethylsilyl-2-diethylphosphonopropionic acid ethyl ester

(E)-2-Trimethylsilanylmethyl-dodec-2-enoic acid ethyl ester
888020-90-4

(E)-2-Trimethylsilanylmethyl-dodec-2-enoic acid ethyl ester

Conditions
ConditionsYield
With sodium hydride In 1,2-dimethoxyethane at 0℃; Wittig-Horner reaction;99%
caprinaldehyde
112-31-2

caprinaldehyde

malononitrile
109-77-3

malononitrile

2-decylidenemalononitrile

2-decylidenemalononitrile

Conditions
ConditionsYield
With hydroquinone; p-benzoquinone In water at 20℃; for 3h; Reagent/catalyst; Solvent; Knoevenagel Condensation; Inert atmosphere; Sealed tube;99%
With Na8H[PW9O34]*7H2O In methanol at 25℃; for 6h; Knoevenagel Condensation;82%
With morpholine In ethanol at 20℃; for 0.0833333h; Knoevenagel condensation;
With 0.04O40PW12(3-)*0.73Mg(2+)*0.22Al(3+)*2HO(1-)*0.98H2O In water; isopropyl alcohol at 60℃; for 6h; Knoevenagel Condensation; chemoselective reaction;88 %Chromat.
With 1-dodecyl-3-(3-triethoxysilylpropyl)-4,5-dihydroimidazolium bromide grafted onto layered double hydroxide In water at 20℃; for 5h; Knoevenagel Condensation;87 %Chromat.
caprinaldehyde
112-31-2

caprinaldehyde

nitromethane
75-52-5

nitromethane

(R)-(-)-1-nitroundecan-2-ol
1244040-51-4

(R)-(-)-1-nitroundecan-2-ol

Conditions
ConditionsYield
With 4-methyl-N-[(1R)-2-{[(1S,2S)-2-{[(2R)-2-(4-methylbenzenesulfonamido)-2-phenylethyl]amino}-1,2-diphenylethy]amino}-1-phenylethyl]benzene-1-sulfonamido; copper(II) acetate monohydrate In ethanol at 20℃; for 48h; Henry reaction; Inert atmosphere; optical yield given as %ee; enantioselective reaction;99%

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.

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