(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane

Modify Date: 2024-01-09 19:19:01

(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure
(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane structure
Common Name (1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane
CAS Number 423165-07-5 Molecular Weight 234.341
Density 1.3±0.1 g/cm3 Boiling Point 402.4±55.0 °C at 760 mmHg
Molecular Formula C13H22N4 Melting Point 117ºC
MSDS N/A Flash Point 197.1±31.5 °C

 Names

Name (1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.3±0.1 g/cm3
Boiling Point 402.4±55.0 °C at 760 mmHg
Melting Point 117ºC
Molecular Formula C13H22N4
Molecular Weight 234.341
Flash Point 197.1±31.5 °C
Exact Mass 234.184448
PSA 42.74000
LogP 1.14
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.678

 Synthetic Route

~99%

(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: WO2008/63600 A2, ; Page/Page column 11-12; 28 ; WO 2008/063600 A2

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(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: US2011/251192 A1, ; US 20110251192 A1

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(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: US2011/251192 A1, ; US 20110251192 A1

~%

(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: US2011/251192 A1, ; US 20110251192 A1

~%

(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: US2011/251192 A1, ; US 20110251192 A1

~%

(1R,3s,5S)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo3.2.1octane Structure

(1R,3s,5S)-3-(3...

CAS#:423165-07-5

Literature: US2011/251192 A1, ; US 20110251192 A1

 Synonyms

(3-exo)-3-(3-Isopropyl-5-methyl-4H-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
(1R,5S)-3-(3-methyl-5-propan-2-yl-1,2,4-triazol-4-yl)-8-azabicyclo[3.2.1]octane
8-Azabicyclo[3.2.1]octane, 3-[3-methyl-5-(1-methylethyl)-4H-1,2,4-triazol-4-yl]-, (3-exo)
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