ChemSpider 2D Image | 1-[(3s,5s,7s)-Adamantan-1-ylcarbonyl]proline | C16H23NO3

1-[(3s,5s,7s)-Adamantan-1-ylcarbonyl]proline

  • Molecular FormulaC16H23NO3
  • Average mass277.359 Da
  • Monoisotopic mass277.167786 Da
  • ChemSpider ID26495954

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

1-[(3s,5s,7s)-Adamantan-1-ylcarbonyl]prolin [German] [ACD/IUPAC Name]
1-[(3s,5s,7s)-Adamantan-1-ylcarbonyl]proline [ACD/IUPAC Name]
1-[(3s,5s,7s)-Adamantan-1-ylcarbonyl]proline [French] [ACD/IUPAC Name]
35084-48-1 [RN]
Proline, 1-(tricyclo[3.3.1.13,7]dec-1-ylcarbonyl)- [ACD/Index Name]
[35084-48-1] [RN]
1-(Adamantane-1-carbonyl)pyrrolidine-2-carboxylic acid
1-(Adamantane-1-carbonyl)-pyrrolidine-2-carboxylic acid
1-(ADAMANTANE-1-CARBONYL)-PYRROLIDINE-2-CARBOXYLICACID

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

MFCD01837326 [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: 482.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 81.8±6.0 kJ/mol
Flash Point: 245.5±26.8 °C
Index of Refraction: 1.598
Molar Refractivity: 72.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.71
ACD/LogD (pH 7.4): -1.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 213.5±3.0 cm3

Click to predict properties on the Chemicalize site


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