Found 79 results

Search term: MF = 'C_{40}H_{52}O_{4}'
ChemSpider 2D Image | 3,3'-Dihydroxy-beta,beta-carotene-4,4'-dione | C40H52O4

3,3'-Dihydroxy-β,β-carotene-4,4'-dione

  • Molecular FormulaC40H52O4
  • Average mass596.839 Da
  • Monoisotopic mass596.386536 Da
  • ChemSpider ID2159

More details:

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

3,3'-Dihydroxy-β,β-carotene-4,4'-dione [ACD/IUPAC Name]
3,3'-Dihydroxy-β,β-carotène-4,4'-dione [French] [ACD/IUPAC Name]
3,3'-Dihydroxy-β,β-carotin-4,4'-dion [German] [ACD/IUPAC Name]
β,β-Carotene-4,4'-dione, 3,3'-dihydroxy- [ACD/Index Name]

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

DivK1c_006649 [DBID]
KBio1_001593 [DBID]
KBio2_001640 [DBID]
KBio2_004208 [DBID]
KBio2_006776 [DBID]
KBio3_001956 [DBID]
KBioGR_001802 [DBID]
KBioSS_001640 [DBID]
NCI60_011909 [DBID]
SpecPlus_000553 [DBID]
More...

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

Density: 1.1±0.1 g/cm3
Boiling Point: 774.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.4±6.0 kJ/mol
Flash Point: 435.8±29.4 °C
Index of Refraction: 1.595
Molar Refractivity: 189.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 8.09
ACD/LogD (pH 5.5): 7.17
ACD/BCF (pH 5.5): 166854.61
ACD/KOC (pH 5.5): 190426.11
ACD/LogD (pH 7.4): 7.17
ACD/BCF (pH 7.4): 166852.78
ACD/KOC (pH 7.4): 190424.02
Polar Surface Area: 75 Å2
Polarizability: 75.1±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 557.1±3.0 cm3

Click to predict properties on the Chemicalize site


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