1,1-Dimethoxyethyl(dimethyl)amin

1,1-Dimethoxyethyl(dimethyl)amine

HCID 87835CAS 18871-66-4

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Grundinformationen

Standard-SMILES: COC(C)(OC)N(C)C
InChIKey: FBZVZUSVGKOWHG-UHFFFAOYSA-N
Summenformel: C6H15NO2
Durchschnittliche Molmasse: 133,19 g/mol
Monoisotopische Masse: 133,11027872

Namen und Bezeichner

Bevorzugter Name: 1,1-Dimethoxyethyl(dimethyl)amine
IUPAC: 1,1-dimethoxy-N,N-dimethylethanamine
Lokaler Name: 1,1-Dimethoxyethyl(dimethyl)amin
Englischer Name: 1,1-Dimethoxy-N,N-dimethylethylamine
Summenformel: C6H15NO2
Molmasse: 133.19

Namen und Synonyme

18871-66-4Ethanamine, 1,1-dimethoxy-N,N-dimethyl-1,1-Dimethoxyethyl(dimethyl)aminedimethylacetamide dimethyl acetalEINECS 242-641-0DTXSID10172242RefChem:409937DTXCID5094733242-641-0N,N-Dimethylacetamide dimethyl acetal1,1-dimethoxy-n,n-dimethylethanamine1,1-Dimethoxy-N,N-dimethylethylamine

Weitere Namen anzeigen

N,N' DIMETHYLACacetamide dimethyL1,1-Dimethoxy-N,N-diEmpagliflozin Impurity 196DimethylacetamideDimethylacetal1,1-Dimethoxy-N,N-dimethylamine

(1,1-dimethoxyethyl)dimethylamineMFCD000084761,1-dimethoxy-N,N-dimethylethan-1-amineN,N-Dimethylacetamide dimethylacetalN,N-Dimethylacetamide dimethyl acetal, stabilized with 5-10% Methanol(1,1-Dimethoxy-ethyl)-dimethyl-amineDimethylacetamide DimethylacetalN-(1,1-Dimethoxyethyl)dimethylamine

Datenbank-Bezeichner

CAS: 18871-66-4
PubChem CID: 87835
DTXSID: DTXSID10172242
UNII: H3SW669ZSK
EC Number: 242-641-0
Nikkaji: J208.388D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,4
Polarare Oberfläche (TPSA): 21,7 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 3
Schwere Atome: 9
Formalladung: 0
Komplexität: 79,1

Physikochemische Eigenschaften

Siedepunkt: 118 °C · 118 °C(lit.)
Dichte: 0.911 g/mL · 0.911 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.411(lit.)
Flammpunkt: 47 °F · 47 °F
storage temp.: 2 · 2-8°C
Aggregatzustand: Liquid
pka: 5.08 · 5.08±0.50(Predicted)
Farbe: Clear colorless
Wasserlöslichkeit: Hydrolyzes in water.
BRN: 1420865 · 1420865
InChI: InChI=1S/C6H15NO2/c1-6(8-4,9-5)7(2)3/h1-5H3
InChIKey: FBZVZUSVGKOWHG-UHFFFAOYSA-N
SMILES: C(N(C)C)(OC)(OC)C
CAS Datenbank: 18871 · 18871-66-4(CAS DataBase Reference)
NIST chemische Informationen: N,N-Dimethylacetamide dimethyl acetal(18871-66-4)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H225 (92%): Highly Flammable liquid and vapor [Danger Flammable liquids]

P210, P233, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P308+P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 50 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 2 Einträge

Chemical: Ethanamine, 1,1-dimethoxy-N,N-dimethyl-

1,1-Dimethoxyethyl(dimethyl)amine: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesFlam. Liq. 2 (92%)

Sicherheitsdaten

F: 8-10-21
wgk: 3
ridadr: UN 1993 3/PG 2
hs_code: 29241990
risk_code: 11-20/21/22-36/37/38-68/20/21/22-68
hazard_code: F,Xn
safety_code: 26-36/37-36/37/39-16
hazard_class: 3
packing_group: II
Speicherklasse: 3 - Flammable liquids
Hazard Classifications: Acute Tox. 3 DermalAcute Tox. 3 InhalationAcute Tox. 4 OralEye Irrit. 2Flam. Liq. 2Skin Irrit. 2STOT SE 2STOT SE 3

Chemie und Industrie

Anwendungen

VerwendenN,N-Dimethylacetamide dimethyl acetal has been used as:one carbon inserting synthon in preparation of pyrimido[1,2-a][1,3,5]triazin-6-onesreagent for the synthesis of amides, diacylamines and heterocycles