ChemSpider 2D Image | 3-Amino-1-adamantanecarboxylic acid | C11H17NO2

3-Amino-1-adamantanecarboxylic acid

  • Molecular FormulaC11H17NO2
  • Average mass195.258 Da
  • Monoisotopic mass195.125931 Da
  • ChemSpider ID26496662

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1r,3s,5R,7S)-3-Amino-1-adamantancarbonsäure [German] [ACD/IUPAC Name]
(1r,3s,5R,7S)-3-Amino-1-adamantanecarboxylic acid [ACD/IUPAC Name]
3-Amino-1-adamantanecarboxylic acid [ACD/IUPAC Name]
3-Amino-adamantane-1-carboxylic acid
6240-10-4 [RN]
Acide (1r,3s,5R,7S)-3-amino-1-adamantanecarboxylique [French] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-carboxylic acid, 3-amino-, (5R,7S)- [ACD/Index Name]
(1r,3s,5R,7S)-3-aminoadamantane-1-carboxylic acid
(5R,7S)-3-aminotricyclo[3.3.1.13,7]decane-1-carboxylic acid
04/10/6240
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD01837822 [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: 334.8±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 63.5±6.0 kJ/mol
Flash Point: 156.3±23.2 °C
Index of Refraction: 1.611
Molar Refractivity: 51.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 20.5±0.5 10-24cm3
Surface Tension: 65.0±3.0 dyne/cm
Molar Volume: 148.8±3.0 cm3

Click to predict properties on the Chemicalize site


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