Chemical Property of alpha-D-glucopyranoside,methyl,3-benzoate 2,6-bis(4-methylbenzenesulfonate)
Chemical Property:
- Boiling Point:765.4±60.0 °C(Predicted)
- PKA:12.12±0.70(Predicted)
- PSA:168.49000
- Density:1.45±0.1 g/cm3(Predicted)
- LogP:4.90220
- XLogP3:3.7
- Hydrogen Bond Donor Count:1
- Hydrogen Bond Acceptor Count:11
- Rotatable Bond Count:11
- Exact Mass:606.12295412
- Heavy Atom Count:41
- Complexity:1050
- Purity/Quality:
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Safty Information:
- Pictogram(s):
- Hazard Codes:
- MSDS Files:
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SDS file from LookChem
Useful:
- Canonical SMILES:CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(C(C(O2)OC)OS(=O)(=O)C3=CC=C(C=C3)C)OC(=O)C4=CC=CC=C4)O
- Isomeric SMILES:CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)OC)OS(=O)(=O)C3=CC=C(C=C3)C)OC(=O)C4=CC=CC=C4)O