1-Amino-3,3-diethoxypropane

HCID 521029CAS 41365-75-7

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: CCOC(CCN)OCC
InChIKey: PXXMSHBZYAOHBD-UHFFFAOYSA-N
Summenformel: C7H17NO2
Durchschnittliche Molmasse: 147,22 g/mol
Monoisotopische Masse: 147,12592879

Namen und Bezeichner

Bevorzugter Name: 1-Amino-3,3-diethoxypropane
IUPAC: 3,3-diethoxypropan-1-amine
Englischer Name: 1-Amino-3,3-diethoxypropane
Summenformel: C7H17NO2
Molmasse: 147.22

Namen und Synonyme

1-Amino-3,3-diethoxypropane41365-75-7DTXSID60334535RefChem:429213DTXCID70285625627-108-63,3-diethoxypropan-1-amine3,3-Diethoxypropylamine3-Aminopropionaldehyde diethylacetalMFCD001425811-Amino-3,3-diethoxypropane (APEA)SCHEMBL366440

Weitere Namen anzeigen

APEA1-Amino-3,3-diethoxypropane,97%TIMTEC-BB SBB005781RARECHEM AL BW 01233,3-Diethoxypropylazanium3,3-DIETHOXY-1-PROPYLAMINE3,3-Diethoxy-1-propanamine

SB75432Propionaldehyde, 3-amino-, diethyl acetalCS-0098622EN300-614791-Amino-3,3-diethoxypropane, >=97%, liquid3-Aminopropionaldehyde Diethyl Acetal1-Propanamine, 3,3-diethoxy-3,3-diethoxy-1-propaneamine

Datenbank-Bezeichner

CAS: 41365-75-7
PubChem CID: 521029
DTXSID: DTXSID60334535
ChEBI: CHEBI:228279
EC Number: 627-108-6
Nikkaji: J254.881J

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 0,2
Polarare Oberfläche (TPSA): 44,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 6
Schwere Atome: 10
Formalladung: 0
Komplexität: 62

Physikochemische Eigenschaften

Siedepunkt: 72 °C · 72 °C (12.0016 mmHg)
Dichte: 0.91 g/mL · 0.91 g/mL at 25 °C(lit.)
Brechungsindex: 1.4233 · 1.4233-1.4253
Flammpunkt: 78 °C · 78 °C
storage temp.: room temp
Löslichkeit: Soluble in water, alcohol, and petroleum ether.
pka: 8.92 · 8.92±0.13(Predicted)
Aggregatzustand: liquid
Farbe: Clear colorless to yellow
Biologische Quelle: synthetic (organic)
Wasserlöslichkeit: water: miscible
InChI: InChI=1S/C7H17NO2/c1-3-9-7(5-6-8)10-4-2/h7H,3-6,8H2,1-2H3
InChIKey: PXXMSHBZYAOHBD-UHFFFAOYSA-N
SMILES: C(N)CC(OCC)OCC
CAS Datenbank: 41365 · 41365-75-7(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (12.8%): Harmful if swallowed [Warning Acute toxicity, oral]；H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P270, P280, P301+P317, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P330, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 47 reports by companies from 6 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (12.8%)；Skin Corr. 1B (100%)

Sicherheitsdaten

wgk: 3
ridadr: UN 3267 8/PG 2
hs_code: 29221985
risk_code: 34
hazard_code: C
safety_code: 26-27-36/37/39-45
hazard_class: 8
packing_group: I
Speicherklasse: 8A - Combustible corrosive hazardous materials
Hazard Classifications: Skin Corr. 1B

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden1-Amino-3,3-diethoxypropane has been used:with alginate in the preparation of hydrogelin the generation of polyethylene glycol (PEG) polyethylenimine (PEI) polyplexes conjugate for transfection studies in hepatocellular carcinoma cell culturesas a component of pH-sensitive PEG derivative for lipopolyplexes formation