ChemSpider 2D Image | [(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-13,18-bis(2-amino-2-oxo-ethyl)-3,7,12,17-tetrakis(2-carboxyethyl)-2-(carboxymethyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-yl]cobalt(1+) | C45H61CoN6O12

[(1R,2R,3R,4Z,7S,9Z,12S,13S,14Z,17S,18S,19R)-13,18-bis(2-amino-2-oxo-ethyl)-3,7,12,17-tetrakis(2-carboxyethyl)-2-(carboxymethyl)-3,5,8,8,13,15,18,19-octamethyl-2,7,12,17-tetrahydro-1H-corrin-21-yl]cobalt(1+)

  • Molecular FormulaC45H61CoN6O12
  • Average mass936.932 Da
  • Monoisotopic mass936.367371 Da
  • ChemSpider ID21864897

  • Charge - Charge

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

Cob(II)yrinate a,c diamide
Cob(II)yrinate diamide
cob(II)yrinic acid a,c diamide
Cob(II)yrinic acid a,c-diamide

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: 18
#H bond donors: 9
#Freely Rotating Bonds: 19
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 313 Å2
Polarizability:
Surface Tension:
Molar Volume:

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