chempirical

2,3-O-Isopropylidene-D-ribonolactone

C8H12O5CAS 30725-00-9188.18 g/mol

Open in Covalent MOL file
OHOOOO
AcetalAlcoholEsterEtherLactone

Properties

Molecular formula
C8H12O5
Molar mass
188.18 g/mol
Exact mass
188.0685 Da
Melting point
138–139 °C
logP
-0.58Crippen estimate
Polar surface area
65.0 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
1
Stereocentres
R, R, Rin SMILES atom order

Hazards

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

Identifiers

CAS number
30725-00-9
SMILES
CC1(C)O[C@@H]2[C@@H](CO)OC(=O)[C@@H]2O1
InChIKey
NHHKFJCWLPPNCN-HSUXUTPPSA-N
InChI
InChI=1S/C8H12O5/c1-8(2)12-5-4(3-9)11-7(10)6(5)13-8/h4-6,9H,3H2,1-2H3/t4-,5-,6-/m1/s1

Weigh it out

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

Names and synonyms

7 names
  • D-Ribonic acid, 2,3-O-(1-methylethylidene)-, γ-lactone
  • Ribonic acid, 2,3-O-isopropylidene-, γ-lactone, D-
  • Ribonic acid, 2,3-O-isopropylidene-, γ-lactone
  • Furo[3,4-d]-1,3-dioxole, D-ribonic acid deriv.
  • 2,3-O-Isopropylidene-D-ribono-1,4-lactone
  • 2,3-O,O′-Isopropylidene-D-ribono-1,4-lactone
  • 2,3-Isopropylidene(D-ribonolactone)

Work with 2,3-O-Isopropylidene-D-ribonolactone

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

(4S,5S)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol50622-09-848 % similar (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dimethanol73346-74-448 % similar 1,2:3,4-Di-O-isopropylidene-α-D-galactopyranose4064-06-645 % similar 4,5-Dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate37031-29-143 % similar 4,5-Dimethyl (4S,5S)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate37031-30-443 % similar 3,4-O-Isopropylidene-D-mannitol3969-84-443 % similar 1,2-O-Isopropylidene-A-L-xylofuranose114861-22-243 % similar 1,2-O-Isopropylidene-α-D-xylofuranose20031-21-443 % similar

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

Same formula

1,4-Dimethyl 2-acetylbutanedioate10420-33-4 Diethyl oxalacetate108-56-5 Dimethyl 3-oxohexanedioate5457-44-3

Elsewhere

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