Found 51 results

Search term: MF = 'C_{27}H_{31}N_{3}O_{9}'
ChemSpider 2D Image | Dimethyl 5-{[(4-{5-[(4-methoxyphenoxy)methyl]-2-oxo-1,3-oxazolidin-3-yl}-1-piperidinyl)carbonyl]amino}isophthalate | C27H31N3O9

Dimethyl 5-{[(4-{5-[(4-methoxyphenoxy)methyl]-2-oxo-1,3-oxazolidin-3-yl}-1-piperidinyl)carbonyl]amino}isophthalate

  • Molecular FormulaC27H31N3O9
  • Average mass541.550 Da
  • Monoisotopic mass541.206055 Da
  • ChemSpider ID2981441

More details:

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

1,3-Benzenedicarboxylic acid, 5-[[[4-[5-[(4-methoxyphenoxy)methyl]-2-oxo-3-oxazolidinyl]-1-piperidinyl]carbonyl]amino]-, dimethyl ester [ACD/Index Name]
5-{[(4-{5-[(4-Méthoxyphénoxy)méthyl]-2-oxo-1,3-oxazolidin-3-yl}-1-pipéridinyl)carbonyl]amino}isophtalate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl 5-{[(4-{5-[(4-methoxyphenoxy)methyl]-2-oxo-1,3-oxazolidin-3-yl}-1-piperidinyl)carbonyl]amino}isophthalate [ACD/IUPAC Name]
Dimethyl-5-{[(4-{5-[(4-methoxyphenoxy)methyl]-2-oxo-1,3-oxazolidin-3-yl}-1-piperidinyl)carbonyl]amino}isophthalat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 792.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.3±3.0 kJ/mol
Flash Point: 433.2±32.9 °C
Index of Refraction: 1.599
Molar Refractivity: 138.7±0.3 cm3
#H bond acceptors: 12
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 203.61
ACD/KOC (pH 5.5): 1564.03
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 203.61
ACD/KOC (pH 7.4): 1564.00
Polar Surface Area: 133 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 406.3±3.0 cm3

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