Found 660 results

Search term: MF = 'C_{10}H_{12}ClN_{5}O_{2}'
ChemSpider 2D Image | N-(2-Chloro-1H-purin-6-yl)-L-valine | C10H12ClN5O2

N-(2-Chloro-1H-purin-6-yl)-L-valine

  • Molecular FormulaC10H12ClN5O2
  • Average mass269.688 Da
  • Monoisotopic mass269.067963 Da
  • ChemSpider ID29766769

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Valine, N-(2-chloro-9H-purin-6-yl)- [ACD/Index Name]
N-(2-Chlor-1H-purin-6-yl)-L-valin [German] [ACD/IUPAC Name]
N-(2-Chloro-1H-purin-6-yl)-L-valine [ACD/IUPAC Name]
N-(2-Chloro-1H-purin-6-yl)-L-valine [French] [ACD/IUPAC Name]
(2S)-2-[(2-chloro-7H-purin-6-yl)amino]-3-methylbutanoic acid
(2S)-2-[(2-CHLORO-9H-PURIN-6-YL)AMINO]-3-METHYLBUTANOIC ACID
(S)-2-((2-chloro-9H-purin-6-yl)amino)-3-methylbutanoic acid
1574304-26-9 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 579.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.2±3.0 kJ/mol
Flash Point: 304.2±30.1 °C
Index of Refraction: 1.699
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.63
ACD/LogD (pH 5.5): -0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.55
ACD/LogD (pH 7.4): -2.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 81.3±3.0 dyne/cm
Molar Volume: 174.4±3.0 cm3

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