Found 1 result

Search term: HXGDFDVLRPRMJW-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | {[25,26,27,28-Tetrahydroxypentacyclo[19.3.1.1~3,7~.1~9,13~.1~15,19~]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrayl]tetrakis(methylene)}tetrakis(phosphonic acid) | C32H36O16P4

{[25,26,27,28-Tetrahydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrayl]tetrakis(methylene)}tetrakis(phosphonic acid)

  • Molecular FormulaC32H36O16P4
  • Average mass800.514 Da
  • Monoisotopic mass800.095398 Da
  • ChemSpider ID24644969

More details:

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

{[25,26,27,28-Tetrahydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaen-5,11,17,23-tetrayl]tetramethylen}tetrakis(phosphonsäure) [German] [ACD/IUPAC Name]
{[25,26,27,28-Tetrahydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodecaene-5,11,17,23-tetrayl]tetrakis(methylene)}tetrakis(phosphonic acid) [ACD/IUPAC Name]
Acide {[25,26,27,28-tétrahydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3(28),4,6,9(27),10,12,15(26),16,18,21,23-dodécaène-5,11,17,23-tétrayl]tetraméthylène}tétrakis(phosphonique) [French] [ACD/IUPAC Name]
Phosphonic acid, [[25,26,27,28-tetrahydroxypentacyclo[19.3.1.13,7.19,13.115,19]octacosa-1(25),3,5,7(28),9,11,13(27),15,17,19(26),21,23-dodecaene-5,11,17,23-tetrayl]tetrakis(methylene)]tetrakis- [ACD/Index Name]
{[25,26,27,28-tetrahydroxy-11,17,23-tris(phosphonomethyl)pentacyclo[19.3.1.1?,?.1?,??.1??,??]octacosa-1(25),3,5,7(28),9(27),10,12,15,17,19(26),21,23-dodecaen-5-yl]methyl}phosphonic acid

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1164.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 180.3±3.0 kJ/mol
Flash Point: 658.2±37.1 °C
Index of Refraction: 1.715
Molar Refractivity: 183.8±0.3 cm3
#H bond acceptors: 16
#H bond donors: 12
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: -4.47
ACD/LogD (pH 5.5): -11.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -12.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 350 Å2
Polarizability: 72.9±0.5 10-24cm3
Surface Tension: 101.1±3.0 dyne/cm
Molar Volume: 467.7±3.0 cm3

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