α-D-Glucopyranose, 1-(dihydrogenphosphate) supplier

Name
glucose 1-(dihydrogen phosphate)
EINECS 200-435-8
CAS No. 59-56-3
Article Data54
CAS DataBase
Density 1.906 g/cm³
Solubility
Melting Point
Formula C₆H₁₃O₉P
Boiling Point 602.991 °C at 760 mmHg
Molecular Weight 260.138
Flash Point 318.478 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Glucopyranose,1-(dihydrogen phosphate), a-D- (8CI);Cori ester;D-Glucose, 1-(dihydrogen phosphate);Glucosemonophosphate;α-D-Glucopyranosylphosphate;α-D-Glucose 1-phosphate;
PSA 166.72000
LogP -3.10440

α-D-Glucopyranose, 1-(dihydrogenphosphate) Specification

The α-D-Glucopyranose, 1-(dihydrogenphosphate), with the CAS registry number 59-56-3, is also known as 1-O-Phosphono-α-D-glucopyranose. It belongs to the product category of 13C & 2H Sugars. Its EINECS registry number is 200-435-8. This chemical's molecular formula is C₆H₁₃O₉P and molecular weight is 260.1358. What's more, its IUPAC name is [(2R,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl]dihydrogen phosphate.

Physical properties about α-D-Glucopyranose, 1-(dihydrogenphosphate) are: (1)# of Rule of 5 Violations: 1; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 9; (7)#H bond donors: 6; (8)#Freely Rotating Bonds: 7; (9)Polar Surface Area: 166.72 Å²; (10)Index of Refraction: 1.607; (11)Molar Refractivity: 47.102 cm³; (12)Molar Volume: 136.468 cm³; (13)Polarizability: 18.673×10^-24cm³; (14)Surface Tension: 112.658 dyne/cm; (15)Density: 1.906 g/cm³; (16)Flash Point: 318.478 °C; (17)Enthalpy of Vaporization: 102.905 kJ/mol; (18)Boiling Point: 602.991 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OP(=O)(O)O)O)O)O)O
(2) InChI: InChI=1/C6H13O9P/c7-1-2-3(8)4(9)5(10)6(14-2)15-16(11,12)13/h2-10H,1H2,(H2,11,12,13)/t2-,3-,4+,5-,6-/m1/s1
(3) InChIKey: HXXFSFRBOHSIMQ-VFUOTHLCBD

Product Name

glucose 1-(dihydrogen phosphate)

α-D-Glucopyranose, 1-(dihydrogenphosphate) Specification

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