Grundinformationen
- Standard-SMILES
CCCCNc1ccccc1- InChIKey
VSHTWPWTCXQLQN-UHFFFAOYSA-N- Summenformel
- C10H15N
- Durchschnittliche Molmasse
- 149,23 g/mol
- Monoisotopische Masse
- 149,12044948
Überblick
N-butylaniline appears as an amber colored liquid. Slightly denser than water and insoluble in water. May be toxic by skin absorption and ingestion. Severely irritates skin and eyes. Used to make dyes.
Namen und Bezeichner
- Bevorzugter Name
- N-Butylaniline
- IUPAC
- N-butylaniline
- Lokaler Name
- N-Butylanilin
- Englischer Name
- N-Phenyl-n-butylamine
- Summenformel
- C10H15N
- Molmasse
- 149.23
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
1126-78-9- PubChem CID
- 14310
- DTXSID
DTXSID9044370- ChEMBL
CHEMBL3187651- UNII
- R2ZNJ7L2UM
- EC Number
- 214-425-6
- Nikkaji
- J1.760D
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,8
- Polarare Oberfläche (TPSA)
- 12 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 84,9
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- -12 °C · -12 °C
- Siedepunkt
- 241 °C · 241 °C
- Dichte
- 0.93 · 0.93
- Brechungsindex
- 1.5325 · 1.5325-1.5345
- Flammpunkt
- 107 °C · 107 °C
- pka
- 5.05 · 5.05±0.20(Predicted)
- Aggregatzustand
- clear liquid
- Farbe
- Light yellow to Brown
- Wasserlöslichkeit
- insoluble
- CAS Datenbank
- 1126 · 1126-78-9(CAS DataBase Reference)
- NIST chemische Informationen
- N-Butylaniline(1126-78-9)
- EPA chemische Informationen
- N-Butylaniline (1126-78-9)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P308+P316, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 99 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Benzenamine, N-butyl-
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.)
Fire Hazards
Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
· Combustible material: may burn but does not ignite readily.
Health Hazards
Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
· TOXIC and/or CORROSIVE; inhalation, ingestion or skin contact with material may cause severe injury or death.
Reactivity Profile
N-BUTYLANILINE 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.
DOT Hazard Classification
N-Butylaniline
UN2738
Div 6.1 Poisonous materials (49 eCFR § 173.132)
PG II: the degree of danger presented by the material is medium
Sicherheit und Schutzausrüstung
Accidental Release Measures
· 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
Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
General First Aid:
Isolation and Evacuation
Excerpt from ERG Guide 153 [Substances - Toxic and/or Corrosive (Combustible)]:
Immediate precautionary measure
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- UN 2738
- hs_code
- 2921420090
- RTECS-Nr.
- BW9450000
- risk_code
- 20/22-36/37/38-22
- hazard_code
- Xn,Xi
- hazard_note
- Irritant
- safety_code
- 28A-37/39-26
- hazard_class
- 6.1
- packing_group
- II
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenN-Butylaniline is used in preparation of Cyano Tertiary Amine.
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