ChemicalBook--->CAS DataBase List--->552-70-5

552-70-5

552-70-5 Structure

552-70-5 Structure
IdentificationMore
[Name]

9-Methyl-9-azabicyclo[3.3.1]nonan-3-one
[CAS]

552-70-5
[Synonyms]

PSEUDO-PELLETIERINE
9-methyl-9-azabicyclo(3.3.1)nonan-3-on
9-methyl-9-azabicyclo(3.3.1)nonan-3-one
granatan-3-one
granatonine
pseudopelletierin
pseudopunicine
psi-pelletierine
9-AZABICYCLO(3.3.1)NONAN-3-ONE,9-METHYL-PSEUDOPELLETIERINE
9-Methyl-3-granataninone
9-Methyl-9-azabicyclo[3.3.1]non-3-one
9-Methyl-9-azabicyclo[3.3.1]nonane-3-one
[EINECS(EC#)]

209-021-1
[Molecular Formula]

C9H15NO
[MDL Number]

MFCD00078161
[Molecular Weight]

153.22
[MOL File]

552-70-5.mol
Chemical PropertiesBack Directory
[Melting point ]

63-65°C
[Boiling point ]

bp 246°
[density ]

1.0010
[refractive index ]

1.4760
[storage temp. ]

2-8°C
[solubility ]

Methanol (Sparingly), Water
[form ]

Solid
[pka]

8.99±0.20(Predicted)
[color ]

Tan
[Merck ]

13,8011
[BRN ]

1525218
[InChIKey]

RHWSKVCZXBAWLZ-UHFFFAOYSA-N
[LogP]

0.630 (est)
[CAS DataBase Reference]

552-70-5(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
[WGK Germany ]

3
[RTECS ]

CL5593500
[HS Code ]

2933998090
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

9-Methyl-9-azabicyclo[3.3.1]nonan-3-one(552-70-5).msds
Hazard InformationBack Directory
[Chemical Properties]

Tan Solid
[Uses]

It was found in the root bark of Punica granatum
[Uses]

It was found in the root bark of Punica granatum L., Punicaceae. Used as a enzyme substrate.
[Definition]

ChEBI: An azabicycloalkane alkaloid that is 9-azabicyclo[3.3.1]nonane substituted by a methyl group at position 9 and an oxo group at position 3. It is found in pomegranate trees.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 73, p. 3416, 1951 DOI: 10.1021/ja01151a123
Spectrum DetailBack Directory
[Spectrum Detail]

9-Methyl-9-azabicyclo[3.3.1]nonan-3-one(552-70-5)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

552-70-5(sigmaaldrich)
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