Product Name: beta-D-Glucopyranoside,4-(hydroxymethyl)phenyl (CAS NO.62499-27-8)

Molecular Formula: C₁₃H₁₈O₇
Molecular Weight: 286.28g/mol
Mol File: 62499-27-8.mol
Index of Refraction: 1.638 
Molar Refractivity: 68.41 cm³ 
Molar Volume: 190.3 cm³ 
Surface Tension: 70.1 dyne/cm 
Density: 1.504 g/cm³ 
Flash Point: 294.4 °C 
Enthalpy of Vaporization: 89.06 kJ/mol 
Boiling Point: 563.2 °C at 760 mmHg 
Vapour Pressure: 1.6E-13 mmHg at 25°C
XLogP3-AA: -0.8
H-Bond Donor: 5
H-Bond Acceptor: 7
Structure Descriptors of beta-D-Glucopyranoside,4-(hydroxymethyl)phenyl (CAS NO.62499-27-8):
  IUPAC Name: (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-[4-(hydroxymethyl)phenoxy]oxane-3,4,5-triol
  Canonical SMILES: C1=CC(=CC=C1CO)OC2C(C(C(C(O2)CO)O)O)O
  Isomeric SMILES: C1=CC(=CC=C1CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O
  InChI: InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1 
  InChIKey: PUQSUZTXKPLAPR-UJPOAAIJSA-N
Product Categories: Benzhydrols, Benzyl & Special Alcohols; Natural Plant Extract

 beta-D-Glucopyranoside,4-(hydroxymethyl)phenyl , its CAS NO. is 62499-27-8, the synonym is Gastrodine ; Gastrodin .