CAS 84545-14-2 4-(Chloromethyl)benzamide (HCID 458363)

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

CAS: 84545-14-2
Standard-SMILES: NC(=O)c1ccc(CCl)cc1
InChIKey: OVILZFVTUVWJTO-UHFFFAOYSA-N
Summenformel: C8H8ClNO
Durchschnittliche Molmasse: 169,61 g/mol
Monoisotopische Masse: 169,0294416

Namen und Bezeichner

Bevorzugter Name: 4-(Chloromethyl)benzamide
IUPAC: 4-(chloromethyl)benzamide
Englischer Name: Benzamide, 4-(chloromethyl)- (9CI)
Summenformel: C8H8ClNO
Molmasse: 169.61

Namen und Synonyme

4-(Chloromethyl)benzamide84545-14-2DTXSID30332508RefChem:515660DTXCID70283601800-992-2MFCD00175950Benzamide, 4-(chloromethyl)-4-(chloromethyl)-benzamidealpha-Chloro-p-toluamide4-(Chloromethyl)benzamide #SCHEMBL186305

Weitere Namen anzeigen

4-(chloromethyl)phenyl carboxamideBenzamide, 4-(chloromethyl)- (9CI)4-(chloromethyl)benzamide(SALTDATA: FREE)

STL282799AKOS001208898AC-25080BS-13402Letrozole Impurity N2Letrozole Impurity 41SCHEMBL3417750SCHEMBL10908999

Datenbank-Bezeichner

CAS: 84545-14-2
PubChem CID: 458363
DTXSID: DTXSID30332508
EC Number: 800-992-2
Nikkaji: J3.356.293D

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,2
Polarare Oberfläche (TPSA): 43,1 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 1
Frei drehbare Bindungen: 2
Schwere Atome: 11
Formalladung: 0
Komplexität: 141

Physikochemische Eigenschaften

storage temp.: Inert atmosphere,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H314 (50%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]；H315 (50%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (50%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

P260, P261, P264, P264+P265, P271, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P319, P321, P332+P317, P337+P317, P362+P364, P363, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 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.