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Butyraldehydoxim

Butanal, oxime

HCID 8069
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GrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
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Grundinformationen

CAS
110-69-0
Standard-SMILES
CCCC=NO
InChIKey
KGGVGTQEGGOZRN-UHFFFAOYSA-N
Summenformel
C4H9NO
Durchschnittliche Molmasse
87,12 g/mol
Monoisotopische Masse
87,06841391

Überblick

Butyraldoxime appears as a liquid. Flash point 140 °F. Slightly less dense than water. Vapors heavier than air. Used to make plastics and rubber.

Namen und Bezeichner

Bevorzugter Name
Butanal, oxime
IUPAC
N-butylidenehydroxylamine
Lokaler Name
Butyraldehydoxim
Englischer Name
Butyraldehyde oxime
Summenformel
C4H9NO
Molmasse
87.12

Namen und Synonyme

BUTYRALDOXIMEButanal oximeButyraldehyde oxime110-69-0Butanal, oximebutanaldoximen-ButyraldoximeDTXSID2024664n-ButylaldoximeButylaldoximen-Butyraldehyde oximeExkin 1
Weitere Namen anzeigen
exkin1skino#1usafam-6Skino No. 1utraldoxime
Troykyd Anti-skin BTOCHEBI:59012USAF AM-6Butyraldehyde, oximeExkin No. 1 anti-skinning agentG4CAF8L77SDTXCID004664NSC-1487

Datenbank-Bezeichner

CAS
110-69-0
PubChem CID
8069
DTXSID
DTXSID2024664
ChEMBL
CHEMBL1729186
ChEBI
CHEBI:59012
EC Number
203-792-8

Eigenschaften

Berechnete Struktureigenschaften

XLogP
0,8
Polarare Oberfläche (TPSA)
32,6 Ų
H-Brücken-Donoren
1
H-Brücken-Akzeptoren
2
Frei drehbare Bindungen
2
Schwere Atome
6
Formalladung
0
Komplexität
42,8

Experimentelle und physikochemische Eigenschaften

Chemical Classes · 2 Einträge

Nitrogen Compounds -> Oximes

Flammable agents - 2nd degree

Density0.923 (NTP, 1992) - Less dense than water; will float
Solubilityless than 1 mg/mL at 68 °F (NTP, 1992)
Flash Point136 °F (NTP, 1992)
Boiling Point306 °F at 760 mmHg (NTP, 1992)
Melting Point-21.1 °F (NTP, 1992)
Vapor Density3.01 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Physical Description · 2 Einträge

Butyraldoxime appears as a liquid. Flash point 140 °F. Slightly less dense than water. Vapors heavier than air. Used to make plastics and rubber.

Clear colorless liquid; [NTP]

Physikochemische Eigenschaften

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 6 Einträge

Danger

H302: Harmful if swallowed [Warning Acute toxicity, oral]

P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P316, P321, P330, P337+P317, P361+P364, P405, and P501 (click each P-code to see the statement)

Danger

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P262, P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P316, P321, P330, P337+P317, P361+P364, P405, and P501 (click each P-code to see the statement)

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Butanal, oxime

Butyraldehyde oxime: 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 129 [Flammable Liquids (Water-Miscible / Noxious)]:

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

Health Hazards · 2 Einträge

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

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

Hazards Summary · 1 Eintrag

Methemoglobinemia (with associated anemia), hepatocellular necrosis (in animals that died during study), nasal olfactory epithelial degeneration observed in 14-week oral study of mice and rats; [NTP] An eye irritant; Harmful by ingestion; Toxic by skin absorption; [Alfa Aesar MSDS]

Chemie und Industrie

Verwendung und Herstellung

Uses · 2 Einträge

Used to make plastics and rubber; [CAMEO] Used as an anti-skinning agent in paints, inks, adhesives, and other products; [NTP] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]

Painting (Pigments, Binders, and Biocides) [Category: Paint]

General Manufacturing InformationButanal, oxime: ACTIVE
Darstellung · 1 Eintrag

synthetischeTo a slowly stirred mixture of 73 gm (1 mole) of butylamine and 109 gm of a 12.2% aqueous solution of sodium tungstate is added (1.75 hr) with cooling to maintain a temperature of 15°C, 220 gm of 28% hydrogen peroxide. During this reaction 130 ml of ethanol is added portionwise to clarify the emulsion which tends to form. The green solution is stirred at 15°C for an additional hour after the addition has been completed. The reaction mixture is cooled, neutralized, and freed of the ethanol under reduced pressure. The solution is then saturated with sodium chloride and the oily product is separated and distilled to afford 50 gm (58%), b.p. 152°C. Evidently hydroxylamines may also be oxidized with hydrogen peroxide in the presence of sodium tungstate, as mentioned above. In a recent report, phenylglyoxime was prepared by a ferric chloride oxidation of the correspondingly hydroxylamine oxime.

Vor- und nachgelagerte Produkte

Nachgelagerte Produkte

1-Nitrobutan3-ethylquinoline-4-carboxylic acid5-Propyl-2H-tetrazole

Anbieter39 Anbieter

Zugehörige Reaktionen

4
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 697190
HRID 697190als EduktTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaktionsgleichung von HRID 917947
HRID 917947als Eduktuspto-grants-1976_07
Reaktionsgleichung von HRID 1681926
HRID 1681926als Eduktuspto-grants-1992_12
Reaktionsgleichung von HRID 1807511
HRID 1807511als Eduktuspto-grants-2013_01

Notizen zur Verbindung

Wird geladen…

Auf dieser SeiteGrundinformationenÜberblickNamen und BezeichnerEigenschaftenSicherheit und RegulatorischesChemie und IndustrieZugehörige ReaktionenNotizen zur Verbindung
Schmelzpunkt
-29.5 °C · -29.5°C
Siedepunkt
152 · 152-154 °C
Dichte
0.923 · 0.923
Brechungsindex
1.4367 · 1.4367
Flammpunkt
58 °C · 58 °C
storage temp.
Refrigerator, under inert atmosphere
Löslichkeit
Chloroform, Methanol (Slightly)
Aggregatzustand
Oil
pka
11.03 · 11.03±0.11(Predicted)
Farbe
Colourless
Wasserlöslichkeit
0.1 g/100 · <0.1 g/100 mL at 20 ºC
BRN
1698799 · 1698799
Stabilität
Stable. Combustible. Incompatible with strong oxidizing agents, powdered metals, acids.
CAS Datenbank
110 · 110-69-0(CAS DataBase Reference)
NIST chemische Informationen
Butanal, oxime(110-69-0)
EPA chemische Informationen
Butanal oxime (110-69-0)
DOT ID and Guide2840 129
Reactive GroupOximes
Reactivity AlertsExplosive
Reactivity ProfileBUTYRALDOXIME is highly explosive during vacuum distillation. This chemical is incompatible with oxidizing materials. It is also incompatible with metallic impurities. It may react with strong acids. (NTP, 1992)
DOT Hazard Classification · 4 Einträge

Butyraldoxime

UN2840

Class 3 Flammable and combustible liquid (49 eCFR § 173.120)

PG III: the degree of danger presented by the material is minor

Air and Water ReactionsFlammable. Slightly soluble in water.
Hazard Classes and Categories · 4 Einträge

Acute Tox. 4 (100%)

Eye irritation - category 2

Flammable agents - 2nd degree

Acute Tox. 3 *

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / 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

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

General First Aid:

Exposure Control and Personal Protection· Wear positive pressure self-contained breathing apparatus (SCBA).
Nonfire Spill ResponseExcerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Isolation and Evacuation · 2 Einträge

Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:

Immediate precautionary measure

Personal Protective Equipment (PPE)Excerpt from ERG Guide 129 [Flammable Liquids (Water-Miscible / Noxious)]:
Emergency Response Planning GuidelinesCAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient.

Toxikologische Informationen

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

Sicherheitsdaten

tsca
TSCA listed
ridadr
UN 2840
hs_code
2928.00.5000
RTECS-Nr.
ES3500000
risk_code
36-24-22
Toxizität
mouse,LD50,intraperitoneal,200mg/kg (200mg/kg),National Technical Information Service. Vol. AD277-689,
hazard_code
T
safety_code
45-36-23
hazard_class
3
packing_group
III
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Ergänzende Hinweise

DefinitionChEBI: An aldoxime derived from n-butanal.