2,2-Difluorobenzo[d][1,3]dioxol-5-ol

HCID 67356342

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Grundinformationen

CAS: 1211539-82-0
Standard-SMILES: Oc1ccc2c(c1)OC(F)(F)O2
InChIKey: GEHVTOIGEVNIEQ-UHFFFAOYSA-N
Summenformel: C7H4F2O3
Durchschnittliche Molmasse: 174,1 g/mol
Monoisotopische Masse: 174,01285031

Namen und Bezeichner

Bevorzugter Name: 2,2-Difluorobenzo[d][1,3]dioxol-5-ol
IUPAC: 2,2-difluoro-1,3-benzodioxol-5-ol
Englischer Name: 2,2-Difluoro-1,3-benzodioxol-5-ol
Summenformel: C7H4F2O3
Molmasse: 174.1

Namen und Synonyme

2,2-difluorobenzo[d][1,3]dioxol-5-ol1211539-82-02,2-difluorobenzo(d)(1,3)dioxol-5-olRefChem:441111828-148-92,2-difluoro-1,3-benzodioxol-5-ol2,2-Difluorobenzodioxol-5-olMFCD224144992,2-difluoro-2H-1,3-benzodioxol-5-olSCHEMBL2303611LYB539822,2-difluoro-1,3-dioxaindan-5-ol

Weitere Namen anzeigen

AKOS0240563871,3-Benzodioxol-5-ol, 2,2-difluoro-DS-10140SY126916DB-292105CS-0101644EN300-4361425F605890

Datenbank-Bezeichner

CAS: 1211539-82-0
PubChem CID: 67356342
EC Number: 828-148-9

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,1
Polarare Oberfläche (TPSA): 38,7 Å²
H-Brücken-Donoren: 1
H-Brücken-Akzeptoren: 5
Frei drehbare Bindungen: 0
Schwere Atome: 12
Formalladung: 0
Komplexität: 185

Physikochemische Eigenschaften

storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: solid
Farbe: White to off-white

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]；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]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, 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 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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)；Skin Irrit. 2 (50%)；Eye Irrit. 2A (50%)；STOT SE 3 (50%)

Sicherheitsdaten

hs_code: 2932990090

Chemie und Industrie

Anwendungen

Verwenden2,2-Difluorobenzodioxol-5-ol is used in the preparation of isobenzofuro[6,5-f][1,3]benzodioxolones as small molecule inhibitor of insulin-like growth factor-1 receptor.