Grundinformationen
- Standard-SMILES
CCC(C)NC(C)CC- InChIKey
OBYVIBDTOCAXSN-UHFFFAOYSA-N- Summenformel
- C8H19N
- Durchschnittliche Molmasse
- 129,24 g/mol
- Monoisotopische Masse
- 129,15174961
Namen und Bezeichner
- Bevorzugter Name
- DI-Sec-butylamine
- IUPAC
- N-butan-2-ylbutan-2-amine
- Lokaler Name
- Di-sec-butylamin
- Englischer Name
- Di-sec-butylamine
- Summenformel
- C8H19N
- Molmasse
- 129.24
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
626-23-3- PubChem CID
- 12277
- DTXSID
DTXSID90870719- EC Number
- 210-937-9
- Nikkaji
- J94.911F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 12 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 53,6
Experimentelle und physikochemische Eigenschaften
Chemical Classes
Nitrogen Compounds -> Amines, Aliphatic
Corrosives
Physikochemische Eigenschaften
- Schmelzpunkt
- -70 °C · -70°C
- Siedepunkt
- 135 °C765 · 135 °C765 mm Hg(lit.)
- Dichte
- 0.753 g/mL · 0.753 g/mL at 25 °C(lit.)
- Brechungsindex
- 20 · n20/D 1.41(lit.)
- Flammpunkt
- 69 °F · 69 °F
- pka
- 1 · pK1:10.91(+1) (25°C)
- Aggregatzustand
- clear liquid
- Farbe
- Colorless to Almost colorless
- InChI
- 1S/C8H19N/c1-5-7(3)9-8(4)6-2/h7-9H,5-6H2,1-4H3
- InChIKey
- OBYVIBDTOCAXSN-UHFFFAOYSA-N
- SMILES
- CCC(C)NC(C)CC
- LogP
- 2.63 · 2.63
- CAS Datenbank
- 626 · 626-23-3(CAS DataBase Reference)
- NIST chemische Informationen
- 2 · 2-Butanamine, N-(1-methylpropyl)-(626-23-3)
- EPA chemische Informationen
- 2 · 2-Butanamine, N-(1-methylpropyl)- (626-23-3)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H226 (100%): Flammable liquid and vapor [Warning Flammable liquids]
P210, P233, P240, P241, P242, P243, P261, P264, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P317, P321, P330, P362+P364, P370+P378, P403+P235, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 80 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
H226: Flammable liquid and vapor [Warning Flammable liquids]
Gefahrenhinweise
Regulatory Information
Status: Active Update: 19-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/24763
Di-s-butylamine: 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.)
Hazard Classes and Categories
Flam. Liq. 3 (100%)
Flammable liquid - category 3
Corrosives, Flammable agents - 3rd degree
Toxikologische Informationen
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2733 3/PG 2
- hs_code
- 29211980
- risk_code
- 11-20/21/22-34-10
- hazard_code
- F,C,Xn
- safety_code
- 16-26-27-33-36/37/39-45
- hazard_class
- 3
- packing_group
- II
- Speicherklasse
- 3 - Flammable liquids
- Hazard Classifications
- Acute Tox. 4 DermalAcute Tox. 4 InhalationAcute Tox. 4 OralFlam. Liq. 3
Chemie und Industrie
Verwendung und Herstellung
Anwendungen
VerwendenDi-sec-butylamine is an aliphatic amine of research interest that has been studied for its properties to attach to carbon and metal surfaces, proton affinity, as well as hydrodesulfurization and hydrodenitrogenation in petroleum refining.
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