ChemSpider 2D Image | (5E,9Z,11E)-13-Chloro-14,16-dihydroxy-11-{[2-oxo-2-(1-piperidinyl)ethoxy]imino}-3,4,7,8,11,12-hexahydro-1H-2-benzoxacyclotetradecin-1-one | C24H29ClN2O6

(5E,9Z,11E)-13-Chloro-14,16-dihydroxy-11-{[2-oxo-2-(1-piperidinyl)ethoxy]imino}-3,4,7,8,11,12-hexahydro-1H-2-benzoxacyclotetradecin-1-one

  • Molecular FormulaC24H29ClN2O6
  • Average mass476.950 Da
  • Monoisotopic mass476.171417 Da
  • ChemSpider ID24628076

  • Double-bond stereo - Double-bond stereo

More details:

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

(5E,9E,11E)-13-chloro-14,16-dihydroxy-3,4,7,8-tetrahydro-1H-2-benzoxacyclotetradecine-1,11(12H)-dione 11-[O-(2-oxo-2-piperidin-1-ylethyl)oxime]
(5E,9Z,11E)-13-Chlor-14,16-dihydroxy-11-{[2-oxo-2-(1-piperidinyl)ethoxy]imino}-3,4,7,8,11,12-hexahydro-1H-2-benzoxacyclotetradecin-1-on [German] [ACD/IUPAC Name]
(5E,9Z,11E)-13-Chloro-14,16-dihydroxy-11-{[2-oxo-2-(1-piperidinyl)ethoxy]imino}-3,4,7,8,11,12-hexahydro-1H-2-benzoxacyclotetradecin-1-one [ACD/IUPAC Name]
(5E,9Z,11E)-13-Chloro-14,16-dihydroxy-11-{[2-oxo-2-(1-pipéridinyl)éthoxy]imino}-3,4,7,8,11,12-hexahydro-1H-2-benzoxacyclotétradécin-1-one [French] [ACD/IUPAC Name]
1H-2-Benzoxacyclotetradecin-1,11(12H)-dione, 13-chloro-3,4,7,8-tetrahydro-14,16-dihydroxy-, 11-[O-[2-oxo-2-(1-piperidinyl)ethyl]oxime], (5E,9Z,11E)- [ACD/Index Name]
POCHOXIME A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 735.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 398.5±35.7 °C
Index of Refraction: 1.601
Molar Refractivity: 123.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.03
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 2594.97
ACD/KOC (pH 5.5): 9132.38
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 135.38
ACD/KOC (pH 7.4): 476.44
Polar Surface Area: 109 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 360.0±7.0 cm3

Click to predict properties on the Chemicalize site


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