Found 51 results

Search term: MF = 'C_{27}H_{31}N_{3}O_{9}'
ChemSpider 2D Image | Myxochlin C | C27H31N3O9

Myxochlin C

  • Molecular FormulaC27H31N3O9
  • Average mass541.550 Da
  • Monoisotopic mass541.206055 Da
  • ChemSpider ID389847

More details:

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

Benzamide, N,N'-[2-[[(2,3-dihydroxyphenyl)hydroxymethyl]amino]-1,6-hexanediyl]bis[2,3-dihydroxy- [ACD/Index Name]
Myxochlin C
N,N'-(2-{[(2,3-Dihydroxyphenyl)(hydroxy)methyl]amino}-1,6-hexandiyl)bis(2,3-dihydroxybenzamid) [German] [ACD/IUPAC Name]
N,N'-(2-{[(2,3-Dihydroxyphenyl)(hydroxy)methyl]amino}-1,6-hexanediyl)bis(2,3-dihydroxybenzamide) [ACD/IUPAC Name]
N,N'-(2-{[(2,3-Dihydroxyphényl)(hydroxy)méthyl]amino}-1,6-hexanediyl)bis(2,3-dihydroxybenzamide) [French] [ACD/IUPAC Name]

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

C06450 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 867.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.0±3.0 kJ/mol
Flash Point: 478.1±34.3 °C
Index of Refraction: 1.687
Molar Refractivity: 141.7±0.3 cm3
#H bond acceptors: 12
#H bond donors: 10
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 1.46
ACD/BCF (pH 5.5): 6.24
ACD/KOC (pH 5.5): 102.46
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 11.58
ACD/KOC (pH 7.4): 190.18
Polar Surface Area: 212 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 79.2±3.0 dyne/cm
Molar Volume: 372.3±3.0 cm3

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