ChemSpider 2D Image | 4-[4-Acetoxy-5-methoxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-2-oxo-2H,8H-pyrano[2,3-f]chromen-3-yl]phenyl acetate | C30H30O8

4-[4-Acetoxy-5-methoxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-2-oxo-2H,8H-pyrano[2,3-f]chromen-3-yl]phenyl acetate

  • Molecular FormulaC30H30O8
  • Average mass518.554 Da
  • Monoisotopic mass518.194092 Da
  • ChemSpider ID3447521

More details:

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

2H,8H-Benzo[1,2-b:3,4-b']dipyran-2-one, 4-(acetyloxy)-3-[4-(acetyloxy)phenyl]-5-methoxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)- [ACD/Index Name]
4-[4-Acetoxy-5-methoxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-2-oxo-2H,8H-pyrano[2,3-f]chromen-3-yl]phenyl acetate [ACD/IUPAC Name]
4-[4-Acetoxy-5-methoxy-8,8-dimethyl-6-(3-methyl-2-buten-1-yl)-2-oxo-2H,8H-pyrano[2,3-f]chromen-3-yl]phenyl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-[4-acétoxy-5-méthoxy-8,8-diméthyl-6-(3-méthyl-2-butén-1-yl)-2-oxo-2H,8H-pyrano[2,3-f]chromén-3-yl]phényle [French] [ACD/IUPAC Name]

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

DivK1c_006132 [DBID]
KBio1_001076 [DBID]
KBio2_000984 [DBID]
KBio2_003552 [DBID]
KBio2_006120 [DBID]
KBio3_002229 [DBID]
KBioGR_002140 [DBID]
KBioSS_000984 [DBID]
SpecPlus_000036 [DBID]
Spectrum_000504 [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 679.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.7±3.0 kJ/mol
Flash Point: 286.4±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 138.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.40
ACD/LogD (pH 5.5): 6.11
ACD/BCF (pH 5.5): 25699.32
ACD/KOC (pH 5.5): 49912.28
ACD/LogD (pH 7.4): 6.11
ACD/BCF (pH 7.4): 25699.32
ACD/KOC (pH 7.4): 49912.28
Polar Surface Area: 97 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 54.4±5.0 dyne/cm
Molar Volume: 402.9±5.0 cm3

Click to predict properties on the Chemicalize site

Feedback Form