Found 1 result

Search term: 59662743 (Found by CSID)
ChemSpider 2D Image | (3S)-3-[(9E,12E,15E,18E)-9,12,15,18-Tetracosatetraenoyloxy]-4-(trimethylammonio)butanoate | C31H53NO4

(3S)-3-[(9E,12E,15E,18E)-9,12,15,18-Tetracosatetraenoyloxy]-4-(trimethylammonio)butanoate

  • Molecular FormulaC31H53NO4
  • Average mass503.757 Da
  • Monoisotopic mass503.397461 Da
  • ChemSpider ID59662743

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S)-3-[(9E,12E,15E,18E)-9,12,15,18-Tetracosatetraenoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
(3S)-3-[(9E,12E,15E,18E)-9,12,15,18-Tetracosatetraenoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
(3S)-3-[(9E,12E,15E,18E)-9,12,15,18-Tetracosatetraenoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[[(9E,12E,15E,18E)-1-oxo-9,12,15,18-tetracosatetraen-1-yl]oxy]-, inner salt, (2S)- [ACD/Index Name]
Tetracosatetraenoyl carnitine

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 5.14
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1807.69
ACD/KOC (pH 5.5): 11037.25
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1818.00
ACD/KOC (pH 7.4): 11100.25
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement