ChemSpider 2D Image | (-)-norchanoclavine i | C15H18N2O

(-)-norchanoclavine i

  • Molecular FormulaC15H18N2O
  • Average mass242.316 Da
  • Monoisotopic mass242.141907 Da
  • ChemSpider ID58828454

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(-)-norchanoclavine i
(2E)-3-[(4R,5R)-4-Amino-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]-2-methyl-2-propen-1-ol [German] [ACD/IUPAC Name]
(2E)-3-[(4R,5R)-4-Amino-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]-2-methyl-2-propen-1-ol [ACD/IUPAC Name]
(2E)-3-[(4R,5R)-4-Amino-1,3,4,5-tétrahydrobenzo[cd]indol-5-yl]-2-méthyl-2-propén-1-ol [French] [ACD/IUPAC Name]
2-Propen-1-ol, 3-[(4R,5R)-4-amino-1,3,4,5-tetrahydrobenz[cd]indol-5-yl]-2-methyl-, (2E)- [ACD/Index Name]
51743-69-2 [RN]
NORCHANOCLAVINE I, (-)-

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

BIO4SFE1HO [DBID]
UNII:BIO4SFE1HO [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 469.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 237.5±28.7 °C
Index of Refraction: 1.741
Molar Refractivity: 76.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.85
ACD/LogD (pH 5.5): -0.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 62 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 63.9±3.0 dyne/cm
Molar Volume: 188.2±3.0 cm3

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