3,5-Dimethyl-4-nitrosophenol

HCID 236019CAS 19628-76-3

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: Cc1cc(O)cc(C)c1N=O
InChIKey: ZVUJMNCTXGSXSQ-UHFFFAOYSA-N
Summenformel: C8H9NO2
Durchschnittliche Molmasse: 151,16 g/mol
Monoisotopische Masse: 151,06332853

Namen und Bezeichner

Bevorzugter Name: 3,5-Dimethyl-4-nitrosophenol
IUPAC: 3,5-dimethyl-4-nitrosophenol
Englischer Name: 3,5-Dimethyl-4-nitrosophenol
Summenformel: C8H9NO2
Molmasse: 151.16

Namen und Synonyme

3,5-Dimethyl-4-nitrosophenol19628-76-3DTXSID50284616RefChem:271927DTXCID302357674-Nitroso-3,5-xylenolPhenol, 3,5-dimethyl-4-nitroso-3, 4-nitroso-NSC38029NSC-38029Phenol,5-dimethyl-4-nitroso-3,5-Dimethyl-4-nitrosophenol; NSC 38029

Weitere Namen anzeigen

NSC 38029

3,5-Xylenol, 4-nitroso-L85NWV2FLESCHEMBL1578480SCHEMBL11420164ZVUJMNCTXGSXSQ-UHFFFAOYSA-NSTL182521AKOS015951528AKOS022171791

Datenbank-Bezeichner

CAS: 19628-76-3
PubChem CID: 236019
DTXSID: DTXSID50284616
UNII: L85NWV2FLE
EC Number: 808-839-1
Nikkaji: J122.124H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,7
Polarare Oberfläche (TPSA): 49,7 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 3
Frei drehbare Bindungen: 0
Schwere Atome: 11
Formalladung: 0
Komplexität: 137

Physikochemische Eigenschaften

Löslichkeit: Dimethylformamide, Dimethyl Sulfoxide, Methanol
Aggregatzustand: Solid
Farbe: Yellow

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

P264, P264+P265, P270, P280, P301+P316, P305+P351+P338, P321, P330, P337+P317, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 38 reports by companies from 1 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.