N-chenodeoxycholyl-2-fluoro-beta-alanine

Modify Date: 2024-04-07 12:01:43

N-chenodeoxycholyl-2-fluoro-beta-alanine Structure
N-chenodeoxycholyl-2-fluoro-beta-alanine structure
Common Name N-chenodeoxycholyl-2-fluoro-beta-alanine
CAS Number 114818-27-8 Molecular Weight 481.640
Density 1.2±0.1 g/cm3 Boiling Point 670.4±55.0 °C at 760 mmHg
Molecular Formula C27H44FNO5 Melting Point N/A
MSDS N/A Flash Point 359.2±31.5 °C

 Names

Name 3-{[(3α,5β,7α,8ξ,9ξ,14ξ)-3,7-Dihydroxy-24-oxocholan-24-yl]amino}-2-fluoropropanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 670.4±55.0 °C at 760 mmHg
Molecular Formula C27H44FNO5
Molecular Weight 481.640
Flash Point 359.2±31.5 °C
Exact Mass 481.320343
LogP 4.16
Vapour Pressure 0.0±4.6 mmHg at 25°C
Index of Refraction 1.535

 Synonyms

Propanoic acid, 3-[[(3α,5β,7α,8ξ,9ξ,14ξ)-3,7-dihydroxy-24-oxocholan-24-yl]amino]-2-fluoro-
3-{[(3α,5β,7α,8ξ,9ξ,14ξ)-3,7-Dihydroxy-24-oxocholan-24-yl]amino}-2-fluoropropanoic acid