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Cyclodecanone

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Name

Cyclodecanone

EINECS 216-119-8
CAS No. 1502-06-3 Density 0.886 g/cm3
PSA 17.07000 LogP 3.08000
Solubility N/A Melting Point 21-24 °C(lit.)
Formula C10H18O Boiling Point 232.1 °C at 760 mmHg
Molecular Weight 154.252 Flash Point 82.2 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 36
Molecular Structure Molecular Structure of 1502-06-3 (Cyclodecanone) Hazard Symbols IrritantXi
Synonyms

NSC 90293;

Article Data 68

Cyclodecanone Synthetic route

1502-05-2

cyclodecanol

1502-06-3

cyclodecanone

Conditions
ConditionsYield
With nickel In benzene for 7h; Heating;98%
With sodium bromate; 1-n-butyl-3-methylimidazolim bromide at 70℃; for 150h;88%
With ferredoxin reductase; [2Fe–2S] ferredoxin; cytochrome P450 enzyme CYP101C1 In aq. buffer pH=7.4; Enzymatic reaction;25%

2-iodo-cyclodecanone

1502-06-3

cyclodecanone

Conditions
ConditionsYield
With triethyl borane; ytterbium(III) triflate; allyl-trimethyl-silane In tetrahydrofuran at 20℃; for 2h; Inert atmosphere;95%
4885-02-3

Dichloromethyl methyl ether

116232-75-8

B-methoxyborecane

1502-06-3

cyclodecanone

Conditions
ConditionsYield
79%
In not given IR, PMR, mass spectral data, GLC;;79%
87307-15-1

6-bromocyclododecanone

A

1502-06-3

cyclodecanone

B

1654-87-1

trans-decal-9-ol

C

3574-58-1

cis-9-decalol

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride In benzene at 60℃; for 15h;A 4%
B 20%
C 75%
935-31-9

(Z)-cyclodecene

1502-06-3

cyclodecanone

Conditions
ConditionsYield
With (phthalocyaninato)iron(II); zirconium phosphate; oxygen; hydroquinone; palladium dichloride In water; N,N-dimethyl-formamide at 20℃; under 760 Torr; for 3h; Wacker oxidation;51%

methyl cis-11-oxabicyclo[8.1.0]undecane-1-carboxylate

1502-06-3

cyclodecanone

Conditions
ConditionsYield
Stage #1: methyl cis-11-oxabicyclo[8.1.0]undecane-1-carboxylate With methanol; water; sodium hydroxide for 5h; Reflux;
Stage #2: With hydrogenchloride; methanol; water for 1h; Reflux;
47%
6244-48-0

1-vinyl-1-cyclooctanol

1502-06-3

cyclodecanone

Conditions
ConditionsYield
at 650℃; under 0.75006 - 3.00024 Torr;30%
Multi-step reaction with 2 steps
1: 37 percent / iodine, yellow HgO / toluene / Heating
2: 12 percent / AIBN, tri-n-butyltin hydride / benzene / Heating
View Scheme
293-96-9

cyclodecane

1502-06-3

cyclodecanone

Conditions
ConditionsYield
With dihydrogen peroxide; vanadium phosphorus oxide In acetonitrile at 70℃; for 20h;28%
With dihydrogen peroxide; iron(III) chloride In pyridine; acetic acid Mechanism;
With cis-VI(6,6'-Cl2bpy)2O2> In tetrachloromethane; acetonitrile at 20℃; for 0.5h; Oxidation;75 % Chromat.
101999-59-1

10-Iodo-dec-1-en-3-one

A

1502-06-3

cyclodecanone

B

928-80-3

decan-3-one

C

56606-79-2

dec-1-en-3-one

D

38734-07-5

cycloeicosane-1,11-dione

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride In benzene for 3h; Heating; Yields of byproduct given;A 15%
B n/a
C n/a
D n/a
With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride In benzene for 3h; Heating; Yield given. Yields of byproduct given;
101999-59-1

10-Iodo-dec-1-en-3-one

A

1502-06-3

cyclodecanone

B

56606-79-2

dec-1-en-3-one

Conditions
ConditionsYield
With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride In benzene Heating;A 12%
B 6%
With 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride In benzene at 80℃; for 3h;A 15 % Chromat.
B 27 % Chromat.

Cyclodecanone Specification

The Cyclodecanone is an organic compound with the formula C10H18O. The IUPAC name of this chemical is Cyclodecanone. With the CAS registry number 1502-06-3, it is also named as Cyclodecan-1-one. The product's categories are C10; Carbonyl Compounds; Ketones. Besides, it should be stored in a dry, well-ventilated, lightproof place.

Physical properties about Cyclodecanone are: (1)ACD/LogP: 3.02; (2)ACD/LogD (pH 5.5): 3.02; (3)ACD/LogD (pH 7.4): 3.02; (4)ACD/BCF (pH 5.5): 116.05; (5)ACD/BCF (pH 7.4): 116.05; (6)ACD/KOC (pH 5.5): 1045.89; (7)ACD/KOC (pH 7.4): 1045.89; (8)#H bond acceptors: 1; (9)Polar Surface Area: 17.07 Å2; (10)Index of Refraction: 1.444; (11)Molar Refractivity: 46.24 cm3; (12)Molar Volume: 173.9 cm3; (13)Polarizability: 18.33×10-24 cm3; (14)Surface Tension: 29.7 dyne/cm; (15)Density: 0.886 g/cm3; (16)Flash Point: 82.2 °C; (17)Enthalpy of Vaporization: 46.88 kJ/mol; (18)Boiling Point: 232.1 °C at 760 mmHg; (19)Vapour Pressure: 0.06 mmHg at 25 °C.

Uses of Cyclodecanone: it can be used to produce Cyclodecanone oxime at temperature of 20 °C. It will need reagents hydroxylamine; sodium acetate and solvent methanol with reaction time of 1 hour. The yield is about 98%.

When you are using this chemical, please be cautious about it as the following:
It is irritating to the eyes. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C10H18O/c11-10-8-6-4-2-1-3-5-7-9-10/h1-9H2
(2)InChIKey: SXOZDDAFVJANJP-UHFFFAOYAD
(3)Std. InChI: InChI=1S/C10H18O/c11-10-8-6-4-2-1-3-5-7-9-10/h1-9H2
(4)Std. InChIKey: SXOZDDAFVJANJP-UHFFFAOYSA-N

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