Found 2058 results

Search term: MF = 'C_{22}H_{27}NO_{6}'
ChemSpider 2D Image | (6S)-6-isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6H,7H-pyrido[2,1-a]isoquinoline-3-carboxylic acid | C22H27NO6

(6S)-6-isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6H,7H-pyrido[2,1-a]isoquinoline-3-carboxylic acid

  • Molecular FormulaC22H27NO6
  • Average mass401.453 Da
  • Monoisotopic mass401.183838 Da
  • ChemSpider ID71061313

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(6S)-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6-(propan-2-yl)-2H,6H,7H-pyrido[2,1-a]isoquinoline-3-carboxylic acid
(6S)-6-Isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6,7-dihydro-2H-pyrido[2,1-a]isochinolin-3-carbonsäure [German] [ACD/IUPAC Name]
(6S)-6-Isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6,7-dihydro-2H-pyrido[2,1-a]isoquinoline-3-carboxylic acid [ACD/IUPAC Name]
(6S)-6-isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6H,7H-pyrido[2,1-a]isoquinoline-3-carboxylic acid
2072057-17-9 [RN]
2H-Benzo[a]quinolizine-3-carboxylic acid, 6,7-dihydro-10-methoxy-9-(3-methoxypropoxy)-6-(1-methylethyl)-2-oxo-, (6S)- [ACD/Index Name]
Acide (6S)-6-isopropyl-10-méthoxy-9-(3-méthoxypropoxy)-2-oxo-6,7-dihydro-2H-pyrido[2,1-a]isoquinoléine-3-carboxylique [French] [ACD/IUPAC Name]
(6S)-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6-propan-2-yl-6,7-dihydrobenzo[a]quinolizine-3-carboxylic acid
(S)-6-Isopropyl-10-methoxy-9-(3-methoxypropoxy)-2-oxo-6,7-dihydro-2h-pyrido[2,1-a]isoquinoline-3-carboxylic acid
2072057-17-9 (S-isomer)
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 578.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 303.7±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 106.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 48.81
ACD/KOC (pH 5.5): 511.54
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 2.13
ACD/KOC (pH 7.4): 22.31
Polar Surface Area: 85 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 316.1±5.0 cm3

Click to predict properties on the Chemicalize site


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