Methyl 2,3-O-(1-methylethylidene)-β-D-ribofuranoside

C₉H₁₆O₅CAS 4099-85-8204.22 g/mol

Open in Covalent MOL file

Acetal Alcohol Ether

Properties

Molecular formula: C₉H₁₆O₅
Molar mass: 204.22 g/mol
Exact mass: 204.0998 Da
Boiling point: 92–94 °C (at 0.08 Torr)
logP: -0.13Crippen estimate
Polar surface area: 57.1 Å²
H-bond donors / acceptors: 1 / 5
Rotatable bonds: 2
Stereocentres: R, R, R, Rin SMILES atom order

Identifiers

CAS number

4099-85-8

SMILES

CO[C@@H]1O[C@H](CO)[C@H]2OC(C)(C)O[C@@H]12

InChIKey

DXBHDBLZPXQALN-WCTZXXKLSA-N

InChI

InChI=1S/C9H16O5/c1-9(2)13-6-5(4-10)12-8(11-3)7(6)14-9/h5-8,10H,4H2,1-3H3/t5-,6-,7-,8-/m1/s1

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

Names and synonyms

6 names

β-D-Ribofuranoside, methyl 2,3-O-(1-methylethylidene)-
Ribofuranoside, methyl 2,3-O-isopropylidene-, β-D-
Ribofuranoside, methyl 2,3-O-isopropylidene-
Furo[3,4-d]-1,3-dioxole, β-D-ribofuranoside deriv.
Methyl 2,3-O-isopropylidene-β-D-ribofuranoside
NSC 85191

Work with Methyl 2,3-O-(1-methylethylidene)-β-D-ribofuranoside

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

Similar compounds

1,2:3,4-Di-O-isopropylidene-α-D-galactopyranose4064-06-675 % similar 1,2-O-Isopropylidene-A-L-xylofuranose114861-22-257 % similar 1,2-O-Isopropylidene-α-D-xylofuranose20031-21-457 % similar (4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol50622-09-852 % similar (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol73346-74-452 % similar Methyl β-D-ribofuranoside7473-45-247 % similar Methyl β-D-galactopyranoside1824-94-846 % similar Methyl-α-D-galactose3396-99-446 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

1,3-Dipropanoylglycerol18373-31-4 Diethyl 3-hydroxyglutarate32328-03-3

Elsewhere

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