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HCID 2737521Erstellt: 25. Oktober 2026

6-Fluoro-2,3-dihydro-4H-1-benzothiopyran-4-one

BUTTPARK 29\07-31 · 6-Fluorothio-4-chromanone · 6-Fluorothiochroman-4-one · 6-Fluorothiochroman-4-one97% · 6-Fluorothiochroman-4-one 97% · 6-FLUORO-2,3-DIHYDRO-4H-THIOCHROMEN-4-ONE · 6-FLUORO-3,4-DIHYDRO-2H-1-BENZOTHIIN-4-ONE · 6-Fluoro-2,3-dihydro-4H-1-benzothiopyran-4-one

https://huagongshe.com/de/chemical/2737521

Molekülstruktur von 6-Fluoro-2,3-dihydro-4H-1-benzothiopyran-4-one

Identifikatoren & physikalische Daten

CAS No.21243-18-5
SummenformelC9H7FOS
Durchschnittliche Molmasse182,22 g/mol
Monoisotopische Masse182,02016406 g/mol
SMILESO=C1CCSc2ccc(F)cc21
InChIKeyNBBGHADNMPMHST-UHFFFAOYSA-N
PubChem CID2737521
ChEMBLCHEMBL4281285
EC No.670-936-8
DTXSIDDTXSID50372108

Chemische & physikalische Eigenschaften

XLogP2
Polarare Oberfläche (TPSA)42,4
H-Brücken-Donoren0
H-Brücken-Akzeptoren3
Frei drehbare Bindungen0
Schwere Atome12
Formalladung0
Komplexität195
Schmelzpunkt89-92
Siedepunkt304.3±42.0 °C(Predicted)
Dichte1.335±0.06 g/cm3(Predicted)
LagerbedingungenStorage temp. 2-8°C
CAS Datenbank21243-18-5(CAS DataBase Reference)

Sicherheit & Vorschriften

GHS-EinstufungWarningH302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Zollcode2930200090
R-Sätze (R)36/37/38
GefahrensymboleXi
hazard_noteIrritant
Sicherheitshinweise (S)26-36/37/39