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2548-87-0

Basic Information
CAS No.: 2548-87-0
Name: (E)-2-Octenal
Article Data: 117
Molecular Structure:
Molecular Structure of 2548-87-0 ((E)-2-Octenal)
Formula: C8H14 O
Molecular Weight: 126.199
Synonyms: 2-Octenal,(E)- (8CI); (2E)-Octenal; (E)-2-Octen-1-al; (E)-2-Octenal; (E)-Octen-2-enal;trans-2-Octanal; trans-2-Octenal; trans-Oct-2-en-1-al
EINECS: 219-833-8
Density: 0.846
Melting Point: 3.5°C (estimate)
Boiling Point: 84-86 ºC (19 mmHg)
Flash Point: 150 ºF
Solubility: Insoluble in water; soluble in alcohol.
Appearance: colorless to slightly yellow liquid
Hazard Symbols:
Risk Codes: R36/37/38   
Safety: Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
PSA: 17.07000
LogP: 2.32180
Synthetic route
18409-17-1

(E)-oct-2-en-1-ol

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With dmap; tetrakis(actonitrile)copper(I) hexafluorophosphate; N,N'-di-tert-butylethylenediamine; oxygen In dichloromethane at 20℃; under 760.051 Torr; for 1h; Schlenk technique; Molecular sieve; Sealed tube;99%
With 1-methyl-1H-imidazole; [2,2]bipyridinyl; 2,2,6,6-tetramethyl-piperidine-N-oxyl; TPGS-750-M; copper(I) bromide In water at 20℃; for 9h;93%
With potassium osmate(VI) dihydrate; potassium carbonate; potassium hexacyanoferrate(III) In water; acetonitrile at 60℃; for 14h; chemoselective reaction;88%
7642-04-8

cis-2-octene

13389-42-9

trans-2-Octene

A

2548-87-0

(E)-2-Octenal

B

20664-46-4

cis-2-octene oxide

Conditions
ConditionsYield
With (5,10,15,20-tetramesitylporphyrinato)manganese(III) chloride; 3-chloro-benzenecarboperoxoic acid In water; acetonitrile at 20℃; for 0.166667h; Reagent/catalyst; Concentration; Solvent; Inert atmosphere;A 7%
B 91%
20052-00-0

1,1-Diethoxy 2(E)-octene

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With water for 0.133333h; Microwave irradiation;84%
20739-58-6

2-octyn-1-ol

A

2548-87-0

(E)-2-Octenal

B

20664-46-4

cis-2-octene oxide

Conditions
ConditionsYield
tris(triphenylphosphine)ruthenium(II) chloride; tris(1-methylethyl)phosphine In toluene for 36h; Heating;A 82%
B n/a
103698-50-6

triphenylarsonium salt of bromoacetaldehyde

66-25-1

hexanal

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With water; potassium carbonate In tetrahydrofuran; diethyl ether for 17h; Ambient temperature;81%
With potassium carbonate In tetrahydrofuran; diethyl ether; water at 25℃;81%

2-<(E)heptenyl>-1,3-dioxolane

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With carbon tetrabromide; triphenylphosphine In dichloromethane for 140h; Ambient temperature;80%
With water; toluene-4-sulfonic acid for 4h; Ambient temperature;
20664-46-4

cis-2-octene oxide

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With toluene-4-sulfonic acid In chloroform Heating;75%
94704-96-8

1,1-diethoxy-3-octanol

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With hydrogenchloride In tetrahydrofuran; water for 4h; Heating;75%
86254-73-1

(Z)-1-tert-Butylsulfanyl-oct-1-en-3-ol

A

110-06-5

di-tert-butyl disulfide

B

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With copper(II) oxide In water; acetone for 1h; Ambient temperature;A 33%
B 74%
26001-58-1

(Z)-oct-2-en-1-ol

2548-87-0

(E)-2-Octenal

Conditions
ConditionsYield
With pyridinium chlorochromate In dichloromethane for 3h; low temperature;66%
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Chemistry

Chemistry informtion about (E)-2-Octenal (CAS NO.2548-87-0) is:
IUPAC Name: (E)-Oct-2-Enal
Synonyms: (2e)-2-Octenal ; (E)-2-Octen-1-Al ; (E)-2-Octena ; 2-(E)-Octenal ; Oct-(E)-2-Enal ; Oct-2(E)-Enal ; T2 Octenal ; Trans-2-Octen-1-Al
Product Categories: aldehyde Flavor ; O-P;Alphabetical Listings ; Flavors and Fragrances;Aldehydes ; C8 ; Carbonyl Compounds
MF: C8H14O
MW: 126.2
EINECS: 219-115-4 
Density: 0.832 g/cm3
Flash Point: 65.6 °C 
Boiling Point: 190.1 °C at 760 mmHg
Vapour Pressure: 0.552 mmHg at 25°C 
Enthalpy of Vaporization: 42.63 kJ/mol
Refractive Index: n20/D 1.45(lit.)
FEMA: 3215
Following is the molecular structure of (E)-2-Octenal (CAS NO.2548-87-0) is:

Toxicity Data With Reference

1.    

dnd-ham-fbr 250 µmol/l/1H

    MUREAV    Mutation Research. 497 (2001),185.
2.    

dnd-hmn-oth 300 µmol/l/1H

    MUREAV    Mutation Research. 497 (2001),185.

Safety Profile

Mutation data reported. When heated to decomposition it emits acrid smoke and irritating vapors.
Hazard Codes:
IrritantXi
Risk Statements:
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements:
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
WGK Germany: 3
RTECS: RH2130000

Specification

(E)-2-Octenal (CAS NO.2548-87-0) is a colorless to pale yellow liquid. To protect yourself, you can put on eyeshields, full-face respirator (US), gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter.