Acetamide, N-(4-(chloromethyl)phenyl)-

HCID 148705CAS 54777-65-0

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Grundinformationen

Standard-SMILES: CC(=O)Nc1ccc(CCl)cc1
InChIKey: CRHLVANTDHUAOY-UHFFFAOYSA-N
Summenformel: C9H10ClNO
Durchschnittliche Molmasse: 183,63 g/mol
Monoisotopische Masse: 183,0450916

Namen und Bezeichner

Bevorzugter Name: Acetamide, N-(4-(chloromethyl)phenyl)-
IUPAC: N-[4-(chloromethyl)phenyl]acetamide
Englischer Name: 4-Acetamidobenzyl chloride
Summenformel: C9H10ClNO
Molmasse: 183.63

Namen und Synonyme

4-Acetamidobenzyl chloride54777-65-0N-(4-(Chloromethyl)phenyl)acetamideN-[4-(chloromethyl)phenyl]acetamideAcetamide, N-(4-(chloromethyl)phenyl)-Acetamide, N-[4-(chloromethyl)phenyl]-DTXSID90203245RefChem:551721DTXCID90125736611-197-34'-(Chloromethyl)acetanilideMFCD00060282

Weitere Namen anzeigen

2-[4-(Chloromethyl)phenyl]acetamide4-Acetamidobenzyl chloride, N-[4-(Chloromethyl)phenyl]acetamide

4-Acetamidobenzylchloride4-acetylaminobenzyl chlorideN-[p-(Chloromethyl)phenyl]acetamide4-acetamino-benzylchlorideSCHEMBL1278968CRHLVANTDHUAOY-UHFFFAOYSA-NN-(4-chloromethylphenyl)-acetamiden-(4-chloromethyl-phenyl)-acetamide

Datenbank-Bezeichner

CAS: 54777-65-0
PubChem CID: 148705
DTXSID: DTXSID90203245
EC Number: 611-197-3

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,7
Polarare Oberfläche (TPSA): 29,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 12
Formalladung: 0
Komplexität: 153

Physikochemische Eigenschaften

Schmelzpunkt: 151 · 151-154°C
storage temp.: 2 · 2-8°C
CAS Datenbank: 54777 · 54777-65-0(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H302 (33.3%): Harmful if swallowed [Warning Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (33.3%): Causes serious eye damage [Danger Serious eye damage/eye irritation]；H319 (66.7%): 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+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 3 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.