Properties of ochratoxin B

Identification

• Atoms
  C: 20, H: 19, N: 1, O: 6
• CAS
  4825-86-9
• Formula
  C20H19NO6
• ID
  4825-86-9
• InChI
  C20H19NO6/c1-11-9-13-7-8-14(17(22)16(13)20(26)27-11)18(23)21-15(19(24)25)10-12-5-3-2-4-6-12/h2-8,11,15,22H,9-10H2,1H3,(H,21,23)(H,24,25)/t11-,15+/m1/s1
• InChI Key
  DAEYIVCTQUFNTM-ABAIWWIYSA-N
• IUPAC Name
  (2s)-2-[[(3r)-8-hydroxy-3-methyl-1-oxo-3,4-dihydroisochromene-7-carbonyl]amino]-3-phenylpropanoic acid
• Molecular Weight (kg)
  369.368
• Phase
  s
• PubChem ID
  2.0966e+4
• SMILES
  C[C@@H]1Cc2ccc(C(O)=N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1
• SynonymsView 53 Synonyms

Physical Properties

• Acentric factor
• Critical pressure (bar)
  21.4732
• Critical temperature (°C)
  1166.83
• Critical volume (m³/kmol)
  0
• Dipole moment
• Melting temperature (°C)
  221
• Normal boiling temperature (°C)
  902.49

State-dependent Properties

• Compressibility factor
• Density (kg/m³)
• Dynamic viscosity (cP)
  0
• Enthalpy of vaporization (mass) (kJ)
  0
• Enthalpy of vaporization (molar) (kJ/kmol)
• Gibbs free energy (kJ/kmol)
  0
• Joule–Thomson coefficient
• Kinematic viscosity
• Molar enthalpy (kJ/kmol)
  0
• Molar entropy (kJ/(kmol·K))
  0
• Molar heat capacity (kJ/(kmol·K))
  410.468
• Molar volume (m³/kmol)
  0
• Parachor
• Poynting correction factor
• Prandtl number
• Saturation pressure (bar)
  5.5459e-22
• Saturation temperature (°C)
  902.49
• Solubility parameter
• Specific enthalpy (kJ)
  0
• Specific entropy (kJ/kg·K)
  0
• Specific gravity
• Specific heat capacity (kJ/kg·K)
  1.11127
• Surface tension
  0.0962428
• Thermal conductivity
• Thermal diffusivity

Safety Properties

• Autoignition temperature (°C)
  -273.15
• Flash point temperature (°C)
  -273.15
• Lower flammability limit
  0.00526165
• Upper flammability limit
  0.0334832

Environmental Properties

• Global warming potential
• Ozone depletion potential

Failed Properties:

• API gravityFailed