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| CAS No.: | 7289-52-3 |
|---|---|
| Name: | 1-METHOXYDECANE |
| Article Data: | 20 |
| Molecular Structure: | |
|
|
|
| Formula: | C11H24 O |
| Molecular Weight: | 172.311 |
| Synonyms: | Ether,decyl methyl (7CI,8CI); 1-Methoxydecane; Decyl methyl ether; Methyl decylether; Methyl n-decyl ether |
| EINECS: | 230-718-1 |
| Density: | 0.795 g/cm3 |
| Melting Point: | 189 °C |
| Boiling Point: | 215.2 °C at 760 mmHg |
| Flash Point: | 72.9 °C |
| Solubility: | soluble in alcohol，insoluble in water |
| Appearance: | colorless clear liquid |
| Safety: | Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes. |
| PSA: | 9.23000 |
| LogP: | 3.77350 |
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| Conditions | Yield |
|---|---|
| With [((Me)NN2)NiCl] In tetrahydrofuran; ISOPROPYLAMIDE at -35 - 20℃; Inert atmosphere; | 98% |
| Conditions | Yield |
|---|---|
| With triethylsilane; Naftion-H (perfluororesinsulfonic acid) In dichloromethane for 2h; Heating; | 95.3% |
| Conditions | Yield |
|---|---|
| With potassium hydroxide at 20℃; for 14h; Methylation; | 95% |
| With mercury(II) oxide In toluene at 20℃; for 12h; | 93% |
| tetra(n-butyl)ammonium hydrogensulfate at 40 - 45℃; |
| Conditions | Yield |
|---|---|
| With 3-chloro-benzenecarboperoxoic acid at 20℃; | 87% |
| Conditions | Yield |
|---|---|
| In methanol at 25℃; for 42h; Temperature; | 81.1% |
| Conditions | Yield |
|---|---|
| In methanol at 20℃; for 3h; | 73% |
| Conditions | Yield |
|---|---|
| In methanol at 25℃; for 48h; | A 46% B 35% |
| In methanol; dimethyl sulfoxide at 20℃; Rate constant; estimation H--function; | A n/a B 18.6% |
- 626-17-5
benzene-1,3-dicarbonitrile
- C12H23O3(1-)*Na(1+)
- 1104380-58-6
C12H23O3(1-)*Na(1+)
- 85-01-8
phenanthrene
A
- 7289-52-3
1-methoxydecane
B
- 1104380-72-4
3-(10-methoxydecyl)-1-cyanobenzene
C
- 1104380-73-5
4-(10-methoxydecyl)-1,3-dicyanobenzene
D
- 56666-55-8
9-(9,10-dihydro)phenanthrenecarbonitrile
| Conditions | Yield |
|---|---|
| In water; acetonitrile at 20℃; for 6h; Inert atmosphere; Irradiation; | A 26% B 4% C 11% D 1% |
- 623-26-7
terephthalonitrile
- C12H23O3(1-)*Na(1+)
- 1104380-58-6
C12H23O3(1-)*Na(1+)
- 85-01-8
phenanthrene
A
- 7289-52-3
1-methoxydecane
B
- 1104380-67-7
4-(10-methoxydecyl)-1-cyanobenzene
C
- 56666-55-8
9-(9,10-dihydro)phenanthrenecarbonitrile
| Conditions | Yield |
|---|---|
| In water; acetonitrile at 20℃; for 6h; Inert atmosphere; Irradiation; | A 8% B 25% C 1% |
- C12H23O3(1-)*Na(1+)
- 1104380-58-6
C12H23O3(1-)*Na(1+)
- 85-01-8
phenanthrene
- 91-15-6
phthalonitrile
A
- 7289-52-3
1-methoxydecane
B
- 1104380-70-2
2-(10-methoxydecyl)-1-cyanobenzene
C
- 1104380-71-3
4-(10-methoxydecyl)-1,2-dicyanobenzene
D
- 56666-55-8
9-(9,10-dihydro)phenanthrenecarbonitrile
| Conditions | Yield |
|---|---|
| In water; acetonitrile at 20℃; for 6h; Inert atmosphere; Irradiation; | A 20% B 24% C 5% D 1% |
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Chemistry
Molecule structure of Methyl n-decyl ether (CAS NO.7289-52-3) :
IUPAC Name: 1-methoxydecane
Molecular Weight: 172.30766 g/mol
Molecular Formula: C11H24O
Density: 0.795 g/cm3
Boiling Point: 215.2 °C at 760 mmHg
Flash Point: 72.9 °C
Index of Refraction: 1.419
Molar Refractivity: 54.75 cm3
Molar Volume: 216.4 cm3
Polarizability: 21.7*10-24 cm3
Surface Tension: 26.1 dyne/cm
Enthalpy of Vaporization: 43.31 kJ/mol
Vapour Pressure: 0.219 mmHg at 25 °C
XLogP3: 5.1
H-Bond Acceptor: 1
Rotatable Bond Count: 9
Exact Mass: 172.182715
MonoIsotopic Mass: 172.182715
Topological Polar Surface Area: 9.2
Heavy Atom Count: 12
Complexity: 71.4
Canonical SMILES: CCCCCCCCCCOC
InChI: InChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11-12-2/h3-11H2,1-2H3
InChIKey: JPEWDCTZJFUITH-UHFFFAOYSA-N
EINECS: 230-718-1
Product Categories of Methyl n-decyl ether (CAS NO.7289-52-3) : Anisoles, Alkyloxy Compounds & Phenylacetates
Toxicity Data With Reference
| 1. | skn-rbt 500 mg/24H MOD | FCTOD7 Food and Chemical Toxicology. 20 (1982),667. | ||
| 2. | orl-rat LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 20 (1982),667. | ||
| 3. | skn-rbt LD50:>5 g/kg | FCTOD7 Food and Chemical Toxicology. 20 (1982),667. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Low toxicity by ingestion and skin contact. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.
Specification
Methyl n-decyl ether (CAS NO.7289-52-3) is also called 1-Methoxydecane ; 3-01-00-01760 (Beilstein Handbook Reference) ; BRN 1736529 ; Decane, 1-methoxy- ; Decyl methyl ether ; Methyl decyl ether .