ChemicalBook--->CAS DataBase List--->17931-55-4

17931-55-4

17931-55-4 Structure

17931-55-4 Structure
IdentificationBack Directory
[Name]

BICYCLO[3.3.1]NONAN-9-ONE
[CAS]

17931-55-4
[Synonyms]

Bicyclo[3.3.1]nona-9-one
Bicyclo[3.3.1]-9-nonanone
BICYCLO[3.3.1]NONAN-9-ONE
9-Oxobicyclo[3.3.1]nonane
Bicyclo[3.3.1]nonan-9-one,99%
BICYCLO(3.3.1)NONAN-9-ONE, 98+%
[EINECS(EC#)]

241-868-2
[Molecular Formula]

C9H14O
[MDL Number]

MFCD00074752
[MOL File]

17931-55-4.mol
[Molecular Weight]

138.21
Chemical PropertiesBack Directory
[Appearance]

white to pale yellow crystals, crystalline powder
[Melting point ]

155-157 °C(lit.)
[Boiling point ]

213.64°C (rough estimate)
[density ]

0.9326 (rough estimate)
[refractive index ]

1.4760 (estimate)
[form ]

solid
[InChI]

1S/C9H14O/c10-9-7-3-1-4-8(9)6-2-5-7/h7-8H,1-6H2/t7-,8+
[InChIKey]

SKTMMSQPXGWCAP-OCAPTIKFSA-N
[SMILES]

O=C1[C@@H]2CCC[C@H]1CCC2
Hazard InformationBack Directory
[Chemical Properties]

white to pale yellow crystals, crystalline powder
[Uses]

Bicyclo[3.3.1]nonan-9-one was used in the preparation of bicyclo[3.3.1]nonan-2-ene.
[General Description]

Carbon-13 NMR spectra of solid polycrystalline bicyclo[3.3.1]nonan-9-one has been studied at 315K.
Safety DataBack Directory
[Symbol(GHS) ]

GHS hazard pictograms
GHS07
[Signal word ]

Warning
[Hazard statements ]

H315-H319-H335
[Precautionary statements ]

P271-P261-P280
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

36/37/39-26-22
[WGK Germany ]

3
[HS Code ]

29142900
[Storage Class]

11 - Combustible Solids
Spectrum DetailBack Directory
[Spectrum Detail]

BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)MS
BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)1HNMR
BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)13CNMR
BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)IR1
BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)IR2
BICYCLO[3.3.1]NONAN-9-ONE(17931-55-4)Raman
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