chempirical

Methyl-2,3-O-isopropylidene-D-ribofuranoside

C9H16O5CAS 72402-14-3204.22 g/mol

Open in Covalent MOL file
OOOOHO
AcetalAlcoholEther

Properties

Molecular formula
C9H16O5
Molar mass
204.22 g/mol
Exact mass
204.0998 Da
logP
-0.13Crippen estimate
Polar surface area
57.2 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
2
Stereocentres
R, R, Rin SMILES atom order

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
72402-14-3
SMILES
CC1(O[C@@H]2[C@H](OC([C@@H]2O1)OC)CO)C
InChIKey
DXBHDBLZPXQALN-XDTPYFJJSA-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

Weigh it out

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

Work with Methyl-2,3-O-isopropylidene-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

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 2,3-O-(1-methylethylidene)-β-D-ribofuranoside4099-85-8Stereoisomer

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 2,3-O-Isopropylidene-1-O-methyl-D-ribosic acid54622-95-649 % similar 1,2:3,5-Di-O-isopropylidene-alpha-D-xylofuranose20881-04-349 % similar Methyl β-D-ribofuranoside7473-45-247 % 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

PubChem CAS Common Chemistry NIST WebBook