(Benzylamino)acetaldehyde diethyl acetal

HCID 521961

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Grundinformationen

CAS: 61190-10-1
Standard-SMILES: CCOC(CNCc1ccccc1)OCC
InChIKey: SXFVQTYQHWRYOS-UHFFFAOYSA-N
Summenformel: C13H21NO2
Durchschnittliche Molmasse: 223,31 g/mol
Monoisotopische Masse: 223,15722891

Namen und Bezeichner

Bevorzugter Name: (Benzylamino)acetaldehyde diethyl acetal
IUPAC: N-benzyl-2,2-diethoxyethanamine

Namen und Synonyme

(Benzylamino)acetaldehyde diethyl acetalRefChem:405848641-185-361190-10-1N-Benzyl-2,2-diethoxyethanamineN-Benzylaminoacetaldehyde diethyl acetalMFCD00051599(2,2-diethoxyethyl)benzylaminebenzyl(2,2-diethoxyethyl)amineN-Benzyl-N-(2,2-diethoxyethyl)amineSCHEMBL289500CHEMBL5075867

Weitere Namen anzeigen

n-benzyl-2,2-diethoxy-ethanaminebenzylaminoacetaldehyde diethylacetalN-Benzyl-2,2-diethoxyethanamine #Benzyl-(2,2-diethoxy-ethyl)-amineN-benzyl-2,2-diethoxyethan-1-amineSBB096524n-benzylaminoacetaldehyde diethylacetalAKOS017272998

Datenbank-Bezeichner

CAS: 61190-10-1
PubChem CID: 521961
ChEMBL: CHEMBL5075867
EC Number: 641-185-3
Nikkaji: J308.909F

Eigenschaften

Berechnete StruktureigenschaftenWird ergänzt

XLogP: 1,9
Polarare Oberfläche (TPSA): 30,5 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 8
Schwere Atome: 16
Formalladung: 0
Komplexität: 152

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 6 reports by companies from 3 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.