D-Glucose, 6-(hydrogensulfate) supplier

Name
glucose 6-(hydrogen sulfate)
EINECS
CAS No. 3803-84-7
Article Data17
CAS DataBase
Density 1.841 g/cm³
Solubility
Melting Point
Formula C₆H₁₂O₉S
Boiling Point
Molecular Weight 260.222
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms D-Glucose6-sulfate;D-Glucose-6-O-sulfate;Glucose 6-sulfate;
PSA 169.97000
LogP -2.47090

D-Glucose, 6-(hydrogensulfate) Specification

The D-Glucose, 6-(hydrogensulfate), with the CAS registry number 3803-84-7, is also known as D-glucose 6-sulfate. This chemical's molecular formula is C₆H₁₂O₉S and molecular weight is 260.22. What's more, its systematic name is 6-O-sulfo-D-glucose.

Physical properties of D-Glucose, 6-(hydrogensulfate) are: (1)ACD/LogP: -2.10; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -5.6; (4)ACD/LogD (pH 7.4): -5.6; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 9; (10)#H bond donors: 5; (11)#Freely Rotating Bonds: 11; (12)Polar Surface Area: 114.97 Å²; (13)Index of Refraction: 1.599; (14)Molar Refractivity: 48.31 cm³; (15)Molar Volume: 141.3 cm³; (16)Polarizability: 19.15×10^-24 cm³; (17)Surface Tension: 108.1 dyne/cm; (18)Density: 1.841 g/cm³.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: O=S(=O)(O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C=O
(2)InChI: InChI=1/C6H12O9S/c7-1-3(8)5(10)6(11)4(9)2-15-16(12,13)14/h1,3-6,8-11H,2H2,(H,12,13,14)/t3-,4+,5+,6+/m0/s1
(3)InChIKey: BCUVLMCXSDWQQC-SLPGGIOYBZ

Product Name

glucose 6-(hydrogen sulfate)

D-Glucose, 6-(hydrogensulfate) Specification

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