ChemSpider 2D Image | Amurensine | C19H19NO4

Amurensine

  • Molecular FormulaC19H19NO4
  • Average mass325.358 Da
  • Monoisotopic mass325.131409 Da
  • ChemSpider ID30791186

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,11R)-15-Methoxy-19-methyl-5,7-dioxa-19-azapentacyclo[9.7.2.02,10.04,8.012,17]icosa-2(10),3,8,12,14,16-hexaen-14-ol [German] [ACD/IUPAC Name]
(1S,11R)-15-Methoxy-19-methyl-5,7-dioxa-19-azapentacyclo[9.7.2.02,10.04,8.012,17]icosa-2(10),3,8,12,14,16-hexaen-14-ol [ACD/IUPAC Name]
(1S,11R)-15-Méthoxy-19-méthyl-5,7-dioxa-19-azapentacyclo[9.7.2.02,10.04,8.012,17]icosa-2(10),3,8,12,14,16-hexaén-14-ol [French] [ACD/IUPAC Name]
11,5-(Iminomethano)-5H-benzo[4',5']cyclohepta[1',2':4,5]benzo[1,2-d]-1,3-dioxol-7-ol, 10,11-dihydro-8-methoxy-13-methyl-, (5R,11S)- [ACD/Index Name]
11,5-(Iminomethano)-5H-benzo[4,5]cyclohepta[1,2-f]-1,3-benzodioxol-7-ol, 10,11-dihydro-8-methoxy-13-methyl-, (5R)-
38695-42-0 [RN]
Amurensine
10481-92-2 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 458.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 231.3±28.7 °C
Index of Refraction: 1.644
Molar Refractivity: 88.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.90
ACD/LogD (pH 7.4): 2.30
ACD/BCF (pH 7.4): 28.08
ACD/KOC (pH 7.4): 316.68
Polar Surface Area: 51 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 245.0±3.0 cm3

Click to predict properties on the Chemicalize site


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