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643-10-7

643-10-7 structural image
Product Name: ALLO-INOSITOL
Formula: C6H12O6
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dry Powder
Boiling Point 291.33 ºC
Melting Point 224.5 ºC
Solubility 0.17 mg/ml
LogP -2.08
Collision Cross Section 148.2 Ų [M+Na]+ [CCS Type: DT, Method: single field calibrated with Agilent tune mix (Agilent)]
Kovats Retention Index 1974 1981
Chemical Classes Biological Agents -> Monosaccharides and Derivatives

COMPUTED DESCRIPTORS

Molecular Weight 180.16 g/mol
XLogP3 -3.7
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 0
Exact Mass 180.06338810 g/mol
Monoisotopic Mass 180.06338810 g/mol
Topological Polar Surface Area 121 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 104
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Myo-inositol is an inositol having myo- configuration. It has a role as a member of compatible osmolytes, a nutrient, an EC 3.1.4.11 (phosphoinositide phospholipase C) inhibitor, a human metabolite, a Daphnia magna metabolite, a Saccharomyces cerevisiae metabolite, an Escherichia coli metabolite and a mouse metabolite.