Grundinformationen
- Standard-SMILES
CCCCCCCCN(C)C- InChIKey
UQKAOOAFEFCDGT-UHFFFAOYSA-N- Summenformel
- C10H23N
- Durchschnittliche Molmasse
- 157,3 g/mol
- Monoisotopische Masse
- 157,18304974
Namen und Bezeichner
- Bevorzugter Name
- Dimethyloctylamine
- IUPAC
- N,N-dimethyloctan-1-amine
- Lokaler Name
- Dimethyl(octyl)amin
- Englischer Name
- N,N-Dimethyloctylamine
- Summenformel
- C10H23N
- Molmasse
- 157.3
Namen und Synonyme
Weitere Namen anzeigen
Datenbank-Bezeichner
- CAS
7378-99-6- PubChem CID
- 16224
- DTXSID
DTXSID2036299- ChEMBL
CHEMBL3183197- UNII
- 20N7H7X4SD
- EC Number
- 230-939-3
- Nikkaji
- J97.830B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,2
- Polarare Oberfläche (TPSA)
- 3,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 69,3
Experimentelle und physikochemische Eigenschaften
Physikochemische Eigenschaften
- Schmelzpunkt
- -57 °C · -57 °C (lit.)
- Siedepunkt
- 195 °C · 195 °C (lit.)
- Dichte
- 0.765 g/mL · 0.765 g/mL at 25 °C (lit.)
- Dampfdichte
- 5.4 · 5.4 (vs air)
- Dampfdruck
- 0.8 mm · 0.8 mm Hg ( 25 °C)
- Brechungsindex
- 20 · n20/D 1.424(lit.)
- Flammpunkt
- 149 °F · 149 °F
- storage temp.
- 30 °C · Store below +30°C.
- Aggregatzustand
- Liquid
- pka
- 9.86 · 9.86±0.28(Predicted)
- Farbe
- Clear
- Wasserlöslichkeit
- slightly soluble
- BRN
- 1698081 · 1698081
- Henry's Law Constant
- 2 · 2.0×10-2 mol/(m3Pa) at 25℃, Yaws (2003)
- InChI
- 1S/C10H23N/c1-4-5-6-7-8-9-10-11(2)3/h4-10H2,1-3H3
- InChIKey
- UQKAOOAFEFCDGT-UHFFFAOYSA-N
- SMILES
- CCCCCCCCN(C)C
- LogP
- 2.17 at · 2.17 at 21℃
- CAS Datenbank
- 7378 · 7378-99-6(CAS DataBase Reference)
- NIST chemische Informationen
- N,N-Dimethyloctylamine(7378-99-6)
- EPA chemische Informationen
- N,N-Dimethyloctylamine (7378-99-6)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (92.6%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P284, P301+P316, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P318, P319, P320, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 203 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: 1-Octanamine, N,N-dimethyl-
1-Octanamine, N,N-dimethyl- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Octanamine, N,N-dimethyl- 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)
Status: No longer Valid Update: 30-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/25761
Octyldimethylamine: Does not have an individual approval but may be used under an appropriate group standard
Sicherheitsdaten
- F
- 10-23
- wgk
- 3
- tsca
- TSCA listed
- ridadr
- UN 2922 8/PG 3
- hs_code
- 29211980
- RTECS-Nr.
- RG8075000
- risk_code
- 25-37/38-41-34-36/37
- Toxizität
- LD50 orally in Rabbit: 162 mg/kg
- hazard_code
- T,C
- safety_code
- 26-39-45-36/37/39-27
- hazard_class
- 8
- packing_group
- III
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 2 InhalationAcute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Repr. 1BSkin Corr. 1BSkin Sens. 1
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information
Wholesale and Retail Trade
1-Octanamine, N,N-dimethyl-: ACTIVE
Anwendungen
VerwendenBarlene(R) 8S is a tertiary amine used typically as an intermediate in the manufacture of quaternary ammonium compounds.
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