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699-99-0

699-99-0 Structure

699-99-0 Structure
IdentificationMore
[Name]

4-Fluoro-1-indanone
[CAS]

699-99-0
[Synonyms]

4-FLUORO-1-INDANONE
4-fluoro-2,3-dihydro-1-indenone
4-FLUORO-INDAN-1-ONE
4-Fluoroindan-1-one 98%
4-Fluoroindan-1-one98%
4-Fluoro-1-indanone, GC 98%
4-fluoro-2,3-dihydroinden-1-one
[Molecular Formula]

C9H7FO
[MDL Number]

MFCD00797829
[Molecular Weight]

150.15
[MOL File]

699-99-0.mol
Chemical PropertiesBack Directory
[Melting point ]

72-76 °C
[Boiling point ]

242.8±29.0 °C(Predicted)
[density ]

1.259±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Soluble in alcohol and chloroform
[form ]

solid
[Appearance]

Off-white to yellow Solid
[InChI]

InChI=1S/C9H7FO/c10-8-3-1-2-7-6(8)4-5-9(7)11/h1-3H,4-5H2
[InChIKey]

HOMSJDBZHCPYHY-UHFFFAOYSA-N
[SMILES]

C1(=O)C2=C(C(F)=CC=C2)CC1
[CAS DataBase Reference]

699-99-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

2914790090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Hazard InformationBack Directory
[Chemical Properties]

white crystal
[Uses]

It is used in medicine and as an important raw material and intermediate used in organic synthesis, pharmaceuticals, agrochemicals and dyestuffs.
[References]

[1] Journal of Medicinal Chemistry, 2016, vol. 59, # 11, p. 5416 - 5431
[2] Patent: US2008/255239, 2008, A1. Location in patent: Page/Page column 18; 19
[3] Journal of Medicinal Chemistry, 2003, vol. 46, # 3, p. 399 - 408
[4] Bulletin de la Societe Chimique de France, 1973, p. 3092 - 3095
[5] Patent: WO2005/123724, 2005, A1
Spectrum DetailBack Directory
[Spectrum Detail]

4-Fluoro-1-indanone(699-99-0)1HNMR
4-Fluoro-1-indanone(699-99-0)19FNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

699-99-0(sigmaaldrich)
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