CAS 57330-49-1 2-Methyl-6-(trifluoromethoxy)-1H-indole (HCID 12180669)

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Grundinformationen

CAS: 57330-49-1
Standard-SMILES: Cc1cc2ccc(OC(F)(F)F)cc2[nH]1
InChIKey: RRLOHUDUPRNMML-UHFFFAOYSA-N
Summenformel: C10H8F3NO
Durchschnittliche Molmasse: 215,17 g/mol
Monoisotopische Masse: 215,05579836

Namen und Bezeichner

Bevorzugter Name: 2-Methyl-6-(trifluoromethoxy)-1H-indole
IUPAC: 2-methyl-6-(trifluoromethoxy)-1H-indole
Englischer Name: 1H-INDOLE, 2-METHYL-6-(TRIFLUOROMETHOXY)-
Summenformel: C10H8F3NO
Molmasse: 215.17

Namen und Synonyme

2-methyl-6-(trifluoromethoxy)-1H-indole57330-49-1DTXSID30479386RefChem:475790DTXCID50430196637-349-92-METHYL-6-TRIFLUOROMETHOXY-1H-INDOLEMFCD111117121H-Indole, 2-methyl-6-(trifluoromethoxy)-SCHEMBL2904269RRLOHUDUPRNMML-UHFFFAOYSA-NAKOS015842619

Weitere Namen anzeigen

SB377362-Methyl-6-(trifluoromethoxy)1H-indoleAS-39085CS-0080633F305296

Datenbank-Bezeichner

CAS: 57330-49-1
PubChem CID: 12180669
DTXSID: DTXSID30479386
EC Number: 637-349-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 3,6
Polarare Oberfläche (TPSA): 25 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 1
Schwere Atome: 15
Formalladung: 0
Komplexität: 231

Physikochemische Eigenschaften

storage temp.: Sealed in dry,Room Temperature

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Danger

H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]；H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H318 (100%): Causes serious eye damage [Danger 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+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 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.