Hexadecyltrimethylammoniumhydrogensulfat
1-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1)
Grundinformationen
- CAS
68214-07-3- Standard-SMILES
CCCCCCCCCCCCCCCC[N+](C)(C)C.O=S(=O)([O-])O- InChIKey
UCRJJNVFJGKYQT-UHFFFAOYSA-M- Summenformel
- C19H43NO4S
- Durchschnittliche Molmasse
- 381,6 g/mol
- Monoisotopische Masse
- 381,29127986
Überblick
See also: Cetyltrimethylammonium (annotation moved to).
Namen und Bezeichner
- Bevorzugter Name
- 1-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1)
- IUPAC
- hexadecyl(trimethyl)azanium;hydrogen sulfate
- Lokaler Name
- Hexadecyltrimethylammoniumhydrogensulfat
- Englischer Name
- Cetyltrimethylammonium hydrogensulfate
- Summenformel
- C19H43NO4S
- Molmasse
- 381.61
Namen und Synonyme
68214-07-31-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1)EINECS 269-286-4DTXSID0071253Ammonium, hexadecyltrimethyl-, hydrogen sulfateRefChem:75884DTXCID0045703Cetyltrimethylammonium hydrogensulfateN,N,N-Trimethylhexadecan-1-aminium hydrogensulfateHexadecyltrimethylammonium hydrogen sulfateHexadecyltrimethylammonium bisulfateHexadecyltrimethylammonium hydrogen sulphate
Weitere Namen anzeigen
Cetyltrimethylaminium·hydrogen sulfateHEXADECYLTRIMETHYLAMMONIUM HYDROGEN- &Hexadecyltrimethylaminium·hydrogen sulfateCetyltrimethylammonium hydrogensulfate 99%Cetyl Trimethyl Ammonium Hydrogen Sulphate
Hexadecyltrimethylammonium hydrogensulphateMFCD00134393hexadecyl(trimethyl)azanium;hydrogen sulfatecetyltrimethylammonium hydrogen sulfateAS-15226hexadecyl(trimethyl)ammonium hydrogen sulfateN,N,N-trimethylhexadecan-1-aminium hydrogen sulfatehexadecyl(trimethyl)azanium
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 85,8 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 15
- Schwere Atome
- 25
- Formalladung
- 0
- Komplexität
- 257
Physikochemische Eigenschaften
- Schmelzpunkt
- 250 · 250-260 °C (dec.) (lit.)
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- Farbe
- White to Off-White
- BRN
- 8398798 · 8398798
- Stabilität
- Hygroscopic
- InChI
- 1S/C19H42N.H2O4S/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(2,3)4;1-5(2,3)4/h5-19H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1
- InChIKey
- UCRJJNVFJGKYQT-UHFFFAOYSA-M
- SMILES
- OS([O-])(=O)=O.CCCCCCCCCCCCCCCC[N+](C)(C)C
- CAS Datenbank
- 68214 · 68214-07-3(CAS DataBase Reference)
- EPA chemische Informationen
- 1 · 1-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1) (68214-07-3)
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
Warning
H302+H312+H332 (57.9%): Harmful if swallowed, in contact with skin or if inhaled [Warning Acute toxicity, oral; acute toxicity, dermal; acute toxicity, inhalation]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 95 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information1-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1): Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesAcute Tox. 4 (57.9%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 2923 90 00
- risk_code
- 36/38
- hazard_code
- Xi
- safety_code
- 26-36
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Verwendung und Herstellung
General Manufacturing Information1-Hexadecanaminium, N,N,N-trimethyl-, sulfate (1:1): ACTIVE
Anwendungen
VerwendenCetyltrimethylammonium hydrogensulfate is commonly used as a surfactant for organic transformation in the aqueous medium.Some of the applications include:Rhodium(I)-catalyzed asymmetric hydrogenation of (Z)-methyl-α-acetamidocinnamate.Asymmetric palladium-catalyzed alkylation of 1,3-diphenyl-2-propenyl acetate with dimethyl malonate.
Anbieter69 Anbieter
阿诺西（上海）生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
北京诺德恒信化工技术有限公司010-84929330 13811281791 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Suzhou ARTK Medchem Co., Ltd.+86-18168183658 · [email protected]
上海仲因实业有限公司2537653158 16621191650 · [email protected]
河北枫嘉新材料科技有限公司+86-0311-87836622 +86-18712993135 · [email protected]
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