CAS 1481-32-9 6-Fluoro-1-indanone (HCID 1519464)

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Grundinformationen

CAS: 1481-32-9
Standard-SMILES: O=C1CCc2ccc(F)cc21
InChIKey: LVUUCFIQQHEFEJ-UHFFFAOYSA-N
Summenformel: C9H7FO
Durchschnittliche Molmasse: 150,15 g/mol
Monoisotopische Masse: 150,04809306

Namen und Bezeichner

Bevorzugter Name: 6-Fluoro-1-indanone
IUPAC: 6-fluoro-2,3-dihydroinden-1-one
Englischer Name: 6-Fluoro-1-indanone
Summenformel: C9H7FO
Molmasse: 150.15

Namen und Synonyme

6-Fluoro-1-indanone1481-32-9DTXSID30364046RefChem:308336DTXCID70315092625-201-66-fluoro-2,3-dihydroinden-1-one6-fluoro-2,3-dihydro-1H-inden-1-one6-fluoroindan-1-one1H-Inden-1-one, 6-fluoro-2,3-dihydro-MFCD013181476fluoro-1-indanone

Weitere Namen anzeigen

6-FLUOROINDANONE6-fluro-indanone6-Fluorindan-1-on6-Fluoro-indan-1-on6-Fluoro-1-indenone6-FLURORO-1-INDANONE6-FLUORORO-1-INDANONE

6-Fluoro-1-indanone, 96%AB08649AC-9650DS-0573BP-10962TS-01973Z8149047286-Fluoro-indan-1-one

Datenbank-Bezeichner

CAS: 1481-32-9
PubChem CID: 1519464
DTXSID: DTXSID30364046
EC Number: 625-201-6
Nikkaji: J2.002.001F

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,8
Polarare Oberfläche (TPSA): 17,1 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 0
Schwere Atome: 11
Formalladung: 0
Komplexität: 178

Physikochemische Eigenschaften

Schmelzpunkt: 56 · 56-60 °C
Siedepunkt: 60 °C/0.07kPa · 60 °C/0.07kPa
Dichte: 1.259 · 1.259±0.06 g/cm3(Predicted)
Flammpunkt: 60 °C/0.5mm · 60°C/0.5mm
storage temp.: Sealed in dry,Room Temperature
Löslichkeit: soluble in Methanol
Aggregatzustand: Crystalline Powder
Farbe: Off-white to pale brown
BRN: 1448695 · 1448695
InChI: InChI=1S/C9H7FO/c10-7-3-1-6-2-4-9(11)8(6)5-7/h1,3,5H,2,4H2
InChIKey: LVUUCFIQQHEFEJ-UHFFFAOYSA-N
SMILES: C1(=O)C2=C(C=CC(F)=C2)CC1
CAS Datenbank: 1481 · 1481-32-9(CAS DataBase Reference)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H302 (87%): Harmful if swallowed [Warning Acute toxicity, oral]

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 46 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (87%)

Sicherheitsdaten

wgk: 2
hs_code: 29147000
risk_code: 36/37/38-22
hazard_code: Xi,Xn
safety_code: 26-36-37
hazard_class: IRRITANT
Speicherklasse: 13 - Non Combustible Solids
Hazard Classifications: Acute Tox. 4 Oral

Chemie und Industrie

Anwendungen · 1 Eintrag

Verwenden6-Fluoro-1-indanone is an intermediate compound that can be used as an organic synthesis raw material for the preparation of pharmaceutical and chemical products. It is also an excellent reaction reagent that can undergo various chemical reactions, including oxidation, reduction and substitution.