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Methyl α-D-mannopyranoside

CAT: 0607-A9988-5000Size: 5 gDry Ice: NoHazardous: No
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CAT#:0607-A9988-5000Size:5 g
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CAS Number
617-04-9
Product Name Alternative
(2R,3S,4S,5S,6S) -2- (hydroxymethyl) -6-methoxytetrahydro-2H-pyran-3,4,5-triol
Purity
0.98
Solubility
≥31 mg/mL in DMSO; ≥4.03 mg/mL in EtOH with ultrasonic; ≥31.8 mg/mL in H2O
Smiles
O[C@@H]1[C@@H] (OC) O[C@H] (CO) [C@@H] (O) [C@@H]1O
Molecular Formula
C7H14O6
Molecular Weight
194.18
Shipping Conditions
Blue Ice
Storage Conditions
Store at -20°C for 3 years.

Chemical Information

Methyl alpha-D-mannopyranoside

Methyl alpha-D-mannoside is a methyl mannoside having alpha-configuration at the anomeric centre. It is a methyl mannoside and an alpha-D-mannoside.

CAS Number617-04-9
PubChem CID101798
IUPAC Name(2R,3S,4S,5S,6S)-2-(hydroxymethyl)-6-methoxyoxane-3,4,5-triol
Molecular FormulaC7H14O6
Molecular Weight194.18
XLogP-2.2
Topological Polar Surface Area99.4
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity163
SMILES
CO[C@@H]1[C@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O
InChI
InChI=1S/C7H14O6/c1-12-7-6(11)5(10)4(9)3(2-8)13-7/h3-11H,2H2,1H3/t3-,4-,5+,6+,7+/m1/s1
InChIKey
HOVAGTYPODGVJG-VEIUFWFVSA-N
Chemical Structure
2D Structure
2D structure of Methyl alpha-D-mannopyranoside
CAS: 617-04-9
CID: 101798
Formula: C7H14O6
MW: 194.18
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight194.18
XLogP3-2.2
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass194.07903816
Monoisotopic Mass194.07903816
Topological Polar Surface Area99.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity163
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes