Methyl α-D-glucopyranoside

C7H14O6CAS 97-30-3194.18 g/mol

Open in Covalent MOL file
OOOHOHOHHO
AcetalAlcoholEther

Properties

Molecular formula
C7H14O6
Molar mass
194.18 g/mol
Exact mass
194.0790 Da
Density
1.0312 g/mL (at 20 °C)
Melting point
168 °C
logP
-2.57Crippen estimate
Polar surface area
99.4 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
2
Stereocentres
S, R, S, S, Rin SMILES atom order

Hazards

Not classified as hazardous under GHS by 464 ECHA notifiers. Aggregated from 464 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
97-30-3
SMILES
CO[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
InChIKey
HOVAGTYPODGVJG-ZFYZTMLRSA-N
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

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

13 names · show all
  • α-D-Glucopyranoside, methyl
  • Glucopyranoside, methyl, α-D-
  • 1-O-Methyl-α-D-glucoside
  • Methyl α-D-glucoside
  • Methyl α-glucopyranoside
  • Methyl α-D-(+)-glucoside
  • 1-O-Methyl-α-D-glucopyranoside
  • α-Methyl D-glucose ether
  • 1-O-Methyl-α-glucopyranoside
  • NSC 102101
  • NSC 214092
  • α-Methylglucoside
  • Methyl alpha-D-glucopyranoside

Work with Methyl α-D-glucopyranoside

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Methyl alpha-D-galactopyranoside monohydrate34004-14-3Hydrate, diastereomer Methyl alpha-D-galactopyranoside3396-99-4Diastereomer Methyl beta-D-galactopyranoside1824-94-8Diastereomer Methyl alpha-D-mannopyranoside617-04-9Diastereomer Methyl β-D-glucopyranoside709-50-2Diastereomer Methyl D-galactopyranoside93302-26-2Stereoisomer

Similar compounds

Methyl β-D-ribofuranoside7473-45-296 % similar Trehalose99-20-770 % similar Glucosylglycerol22160-26-563 % similar α-D-Glucopyranosyl α-D-glucopyranoside dihydrate6138-23-463 % similar Methyl glucose sesquistearate68936-95-858 % similar 4-Methoxyphenyl beta-D-galactopyranoside3150-20-755 % similar 4-Methoxyphenylglucoside6032-32-255 % similar Methyl-2-acetamido-2-deoxy-D-glucopyranoside6082-04-855 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Pinitol10284-63-6 3-O-Methyl-α-D-glucopyranose13224-94-7 Sequoyitol523-92-2 Quebrachitol642-38-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook