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529-17-9

529-17-9 Structure

529-17-9 Structure
IdentificationBack Directory
[Name]

8-METHYL-8-AZABICYCLO[3.2.1]OCTANE
[CAS]

529-17-9
[Synonyms]

TROPANE
1αH,5αH-Tropane
1alphaH,5alphaH-Tropane
2,3-Dihydro-8-methylnortropidine
8-METHYL-8-AZABICYCLO[3.2.1]OCTANE
N-Methyl-8-azabicyclo[3.2.1]octane
8-Azabicyclo[3.2.1]octane, 8-methyl-
(1S,5R)-8-Methyl-8-azabicyclo[3.2.1]octane
(1β,5β)-8-Methyl-8-azabicyclo[3.2.1]octane
[Molecular Formula]

C8H15N
[MDL Number]

MFCD24390172
[MOL File]

529-17-9.mol
[Molecular Weight]

125.21
Chemical PropertiesBack Directory
[Boiling point ]

167-169 °C (lit.)
[density ]

0.931 g/mL at 25 °C (lit.)
[refractive index ]

n20/D 1.477(lit.)
[Fp ]

108 °F
[form ]

liquid
[pka]

11.57±0.20(Predicted)
[Merck ]

13,9847
[InChI]

1S/C8H15N/c1-9-7-3-2-4-8(9)6-5-7/h7-8H,2-6H2,1H3/t7-,8+
[InChIKey]

XLRPYZSEQKXZAA-OCAPTIKFSA-N
[SMILES]

CN1[C@H]2CCC[C@@H]1CC2
[LogP]

1.740 (est)
Safety DataBack Directory
[Symbol(GHS) ]

Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
[Signal word ]

Warning
[Hazard statements ]

H226-H315-H319-H335
[Precautionary statements ]

P210-P302+P352-P305+P351+P338
[Hazard Codes ]

Xi
[Risk Statements ]

10-36/37/38
[Safety Statements ]

16-26-36
[RIDADR ]

UN 1993 3/PG 3
[WGK Germany ]

3
[HazardClass ]

3.2
[PackingGroup ]

III
[Storage Class]

3 - Flammable liquids
[Hazard Classifications]

Eye Irrit. 2
Flam. Liq. 3
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
Hazard InformationBack Directory
[Uses]

Tropane (8-methyl-8-azabicyclo[3.2.1]-octane) is a bridged bicyclic N-containing compound. The 8-methyl-8-azabicyclo[3.2.1]-octane has a tropane ring system, which is an important substructure in a number of natural products and synthetic compounds of biological and medicinal importance. Production of tropane alkaloid in callus and root cultures of seven Hyoscyamus species has been studied. Tropane derivatives are reported to undergo rapid N-methyl inversion.
[General Description]

Tropane (8-methyl-8-azabicyclo[3.2.1]-octane) is a bridged bicyclic N-containing compound. The 8-methyl-8-azabicyclo[3.2.1]-octane has a tropane ring system, which is an important substructure in a number of natural products and synthetic compounds of biological and medicinal importance. Production of tropane alkaloid in callus and root cultures of seven Hyoscyamus species has been studied. Tropane derivatives are reported to undergo rapid N-methyl inversion.
Spectrum DetailBack Directory
[Spectrum Detail]

8-METHYL-8-AZABICYCLO[3.2.1]OCTANE(529-17-9)1HNMR
8-METHYL-8-AZABICYCLO[3.2.1]OCTANE(529-17-9)IR
8-METHYL-8-AZABICYCLO[3.2.1]OCTANE(529-17-9)FT-IR
8-METHYL-8-AZABICYCLO[3.2.1]OCTANE(529-17-9)Raman
529-17-9 suppliers list
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Company Name: Shaanxi Didu New Materials Co. Ltd  
Telephone: +86-86-17392712779 +86-13289823923
Website: www.dideu.com/en/
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