ChemSpider 2D Image | MFCD00144708 | 13C5H1115NO2

MFCD00144708

  • Molecular Formula13C5H1115NO2
  • Average mass123.103 Da
  • Monoisotopic mass123.092789 Da
  • ChemSpider ID21169772

  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

((13)C5,(15)N)-valine
(S)-α-Aminoisovaleric acid-13C5,15N
13C and 15N Labeled L-valine
202407-30-5 [RN]
L-(13C5,15N)Valin [German] [ACD/IUPAC Name]
L-(13C5,15N)Valine [ACD/IUPAC Name]
L-(13C5,15N)Valine [French] [ACD/IUPAC Name]
L-2-Amino-3-methylbutanoic acid-13C5,15N
L-Valine-13C5-15N [ACD/Index Name]
L-Valine-13C5,15N
More...

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

600148_ALDRICH [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Chemical Class:

      An <stereo>L</stereo>-<locant>alpha</locant>-amino acid that is <stereo>L</stereo>-valine in which all five carbons are <smallsup>13</smallsup>C isotopes while the nitrogen is the <smallsup>15</smalls up>N isotope. ChEBI CHEBI:87977
      An L-alpha-amino acid that is L-valine in which all five carbons are (13)C isotopes while the nitrogen is the (15)N isotope. ChEBI CHEBI:87977
      An L-alpha-amino acid that is L-valine in which all five carbons are 13C isotopes while the nitrogen is the 15N isotope. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:87977

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.461
Molar Refractivity: 30.2±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 12.0±0.5 10-24cm3
Surface Tension: 39.8±3.0 dyne/cm
Molar Volume: 110.1±3.0 cm3

Click to predict properties on the Chemicalize site


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