2-Ethylbutyraldehyd

2-Ethylbutyraldehyde

HCID 7359CAS 97-96-1

Grundinformationen

Standard-SMILES
CCC(C=O)CC
InChIKey
UNNGUFMVYQJGTD-UHFFFAOYSA-N
Summenformel
C6H12O
Durchschnittliche Molmasse
100,16 g/mol
Monoisotopische Masse
100,088815

Überblick

2-ethylbutyraldehyde appears as a clear colorless liquid. Less dense than water and insoluble in water. Vapors heavier than air.

Namen und Bezeichner

Bevorzugter Name
2-Ethylbutyraldehyde
IUPAC
2-ethylbutanal
Lokaler Name
2-Ethylbutyraldehyd
Englischer Name
2-Ethylbutyraldehyde
Summenformel
C6H12O
Molmasse
100.16

Namen und Synonyme

2-Ethylbutanal2-ETHYLBUTYRALDEHYDE97-96-1Butanal, 2-ethyl-Diethylacetaldehyde3-Formylpentane2-Ethylbutyric aldehydeButyraldehyde, 2-ethyl-alpha-EthylbutanalEthyl butyraldehyde2-Ethylbutyric aledhydeDiethyl acetaldehyde
Weitere Namen anzeigen
FEMA 24263-ethylpentanal(C2H5)2CHCHO2-ethyl-butanaα-Ethylbutanal2-ethylbutyral
Aldehyde 2-ethylbutyriqueEthylbutyraldehydealpha-EthylbutyraldehydeFEMA No. 2426NSC 6757DTXSID3049380Aldehyde 2-ethylbutyrique [French]EINECS 202-623-5

Datenbank-Bezeichner

CAS
97-96-1
PubChem CID
7359
DTXSID
DTXSID3049380
ChEMBL
CHEMBL273782
ChEBI
CHEBI:173345
UNII
676JY5569P
EC Number
202-623-5
Nikkaji
J35.112A

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,5
Polarare Oberfläche (TPSA)
17,1 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
3
Schwere Atome
7

Experimentelle und physikochemische Eigenschaften

Chemical ClassesFlammable agents - 3rd degree
SpringerMaterials PropertiesChemical shift
Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Density0.808-0.814
Flavoring AgentsEU Flavoring substances
Solubility · 2 Einträge

miscible with alcohol, ether; soluble in water 1 ml in 50 ml

(in ethanol)

Physikochemische Eigenschaften

Schmelzpunkt
-89 °C · -89°C
Siedepunkt
117 °C · 117 °C(lit.)
Dichte
0.814 g/mL · 0.814 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.402(lit.)
FEMA
2426 · 2426 | 2-ETHYLBUTYRALDEHYDE
Flammpunkt
70 °F · 70 °F

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (13.2%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P271, P280, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 1495 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Butanal, 2-ethyl-

Butanal, 2-ethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Butanal, 2-ethyl- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Butanal, 2-ethyl-: Does not have an individual approval but may be used under an appropriate group standard

The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)

DOT LabelFlammable Liquid
Fire Hazards · 2 Einträge

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

· HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames.

Health Hazards · 2 Einträge

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

· May cause toxic effects if inhaled or absorbed through skin.

DOT ID and Guide1178 130
Reactive GroupAldehydes

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Accidental Release Measures · 2 Einträge

· CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.

· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area.

First Aid · 2 Einträge

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:
Isolation and Evacuation · 2 Einträge

Excerpt from ERG Guide 130 [Flammable Liquids (Water-Immiscible / Noxious)]:

Immediate precautionary measure

Sicherheitsdaten

wgk
1
tsca
TSCA listed
ridadr
UN 1178
hs_code
29121900
RTECS-Nr.
ES2625000
risk_code
11-36/37/38

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsCytoplasm

Verwendung und Herstellung

U.S. Production2022: <50,000 lb
Consumer UsesFragrance
Use Classification · 2 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

General Manufacturing InformationButanal, 2-ethyl-: ACTIVE

Anwendungen

OccurrenceReported found in melon, French fried potato, wheaten bread, scallops, citrus fruits, white bread and maize.

Verwenden2-Ethylbutyraldehyde has been used in the preparation of aldoximes using aqueous hydroxylamine.

Anbieter50 Anbieter

山东玖玥生物科技有限公司15553333686
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
Hebei baicao biology science and technology co., ltd+86-19131911055 17824879454 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

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