1-Butylimidazol

Butylimidazole

HCID 61347CAS 4316-42-1
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Grundinformationen

Standard-SMILES
CCCCn1ccnc1
InChIKey
MCMFEZDRQOJKMN-UHFFFAOYSA-N
Summenformel
C7H12N2
Durchschnittliche Molmasse
124,18 g/mol
Monoisotopische Masse
124,10004838

Überblick

N,n-butyl imidazole appears as a colorless to light yellow colored liquid. Insoluble in water and more dense than water. Hence sinks in water. Contact may irritate skin, eyes or mucous membranes. Toxic by ingestion, inhalation or skin absorption.

Namen und Bezeichner

Bevorzugter Name
Butylimidazole
IUPAC
1-butylimidazole
Lokaler Name
1-Butylimidazol
Englischer Name
1-Butylimidazole
Summenformel
C7H12N2
Molmasse
124.18

Namen und Synonyme

1-BUTYLIMIDAZOLE4316-42-11-butyl-1H-imidazole1H-Imidazole, 1-butyl-1-N-ButylimidazoleButylimidazoleC7JXC99E8FNSC-158165DTXSID8073976butyl imidazoleRefChem:571854DTXCID7040239
Weitere Namen anzeigen
SKL15591-Butyl-1-N-ButyLN-BUTYL IMIDAZOLEButyl-N-imidazole1-buthylimidazoleN-Butyl-1H-imidazole
224-335-9N-ButylimidazoleN-(n-Butyl)imidazoleMFCD00042753N-n-butylimidazoleEINECS 224-335-9n-n-butyl imidazoleNSC158165

Datenbank-Bezeichner

CAS
4316-42-1
PubChem CID
61347
DTXSID
DTXSID8073976
ChEMBL
CHEMBL97667
UNII
C7JXC99E8F
EC Number
224-335-9
Nikkaji
J61.488B

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,2
Polarare Oberfläche (TPSA)
17,8 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
1
Frei drehbare Bindungen
3
Schwere Atome
9

Experimentelle und physikochemische Eigenschaften

Chemical ClassesNitrogen Compounds -> Imidazoles
Physical Description · 2 Einträge

N,n-butyl imidazole appears as a colorless to light yellow colored liquid. Insoluble in water and more dense than water. Hence sinks in water. Contact may irritate skin, eyes or mucous membranes. Toxic by ingestion, inhalation or skin absorption.

Colorless to light yellow liquid; [CAMEO] Colorless liquid with an amine-like odor; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Siedepunkt
114 · 114-116 °C12 mm Hg(lit.)
Dichte
0.945 g/mL · 0.945 g/mL at 25 °C(lit.)
Brechungsindex
20 · n20/D 1.480(lit.)
Flammpunkt
230 °F · >230 °F
storage temp.
Refrigerator
Löslichkeit
Soluble in Chloroform, Methanol.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H315 (96.2%): Causes skin irritation [Warning Skin corrosion/irritation]

P260, P261, P264, P264+P265, P271, P280, P284, P302+P352, P304+P340, P305+P354+P338, P316, P317, P319, P320, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 52 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

DOT LabelPoison
Fire HazardsExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Health HazardsExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Hazards SummaryMay cause irritation; Toxic by ingestion, inhalation, and skin absorption; [CAMEO] An irritant that may cause serious eye injury; Highly toxic by inhalation; [Alfa Aesar MSDS]
Reactive GroupAmines, Phosphines, and Pyridines
Reactivity Profile · 1 Eintrag

N,N-BUTYL IMIDAZOLE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.

Sicherheit und Schutzausrüstung

Fire FightingExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
First AidExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Nonfire Spill ResponseExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Isolation and EvacuationExcerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 152 [Substances - Toxic (Combustible)]:

Toxikologische Informationen

Toxicity DataLC50 (rat) = 110 mg/m3/4hr

Sicherheitsdaten

wgk
3
ridadr
UN 2690
hs_code
29332990
risk_code
37/38-41
hazard_code
Xi
safety_code
26-39

Chemie und Industrie

Anwendungen

Verwenden1-Butylimidazole may be used in the synthesis of a heterocyclic mesomeric betaine. It was used in the synthesis of 1-(1-butyl-3-imidazolio)propane-3-sulfonate (BIm3S).

Vor- und nachgelagerte Produkte

Anbieter50 Anbieter

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
河北创海生物科技有限公司+86-86-13131129325 · [email protected]

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