ChemSpider 2D Image | (3S)-4-(2,6-Diphenoxyphenyl)-3-(2-methyl-2-propanyl)-2,3-dihydro-1,3-benzoxaphosphole | C29H27O3P

(3S)-4-(2,6-Diphenoxyphenyl)-3-(2-methyl-2-propanyl)-2,3-dihydro-1,3-benzoxaphosphole

  • Molecular FormulaC29H27O3P
  • Average mass454.497 Da
  • Monoisotopic mass454.169769 Da
  • ChemSpider ID78317414

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-4-(2,6-Diphenoxyphenyl)-3-(2-methyl-2-propanyl)-2,3-dihydro-1,3-benzoxaphosphol [German] [ACD/IUPAC Name]
(3S)-4-(2,6-Diphenoxyphenyl)-3-(2-methyl-2-propanyl)-2,3-dihydro-1,3-benzoxaphosphole [ACD/IUPAC Name]
(3S)-4-(2,6-Diphénoxyphényl)-3-(2-méthyl-2-propanyl)-2,3-dihydro-1,3-benzoxaphosphole [French] [ACD/IUPAC Name]
1,3-Benzoxaphosphole, 3-(1,1-dimethylethyl)-4-(2,6-diphenoxyphenyl)-2,3-dihydro-, (3S)- [ACD/Index Name]
(S)-3-(tert-Butyl)-4-(2,6-diphenoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole
(S)-3-(tert-Butyl)-4-(2,6-diphenoxyphenyl)-2,3-dihydrobenzo[d][1,3]oxaphosphole, 97% (>99% ee)
2446042-08-4 [RN]
MFCD32641150

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

Density:
Boiling Point: 569.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.2±3.0 kJ/mol
Flash Point: 374.2±30.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 8.65
ACD/LogD (pH 5.5): 7.38
ACD/BCF (pH 5.5): 238461.64
ACD/KOC (pH 5.5): 245884.61
ACD/LogD (pH 7.4): 7.38
ACD/BCF (pH 7.4): 238461.64
ACD/KOC (pH 7.4): 245884.61
Polar Surface Area: 41 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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