4,5-Dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Properties
- Molecular formula
- C9H14O6
- Molar mass
- 218.20 g/mol
- Exact mass
- 218.0790 Da
- Melting point
- 40–43 °C
- Boiling point
- 120–122 °C (at 8 Torr)
- logP
- -0.15Crippen estimate
- Polar surface area
- 71.1 Ų
- H-bond donors / acceptors
- 0 / 6
- Rotatable bonds
- 2
- Stereocentres
- R, Rin SMILES atom order
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
37031-29-1SMILES
COC(=O)[C@@H]1OC(C)(C)O[C@H]1C(=O)OCInChIKey
ROZOUYVVWUTPNG-PHDIDXHHSA-NInChI
InChI=1S/C9H14O6/c1-9(2)14-5(7(10)12-3)6(15-9)8(11)13-4/h5-6H,1-4H3/t5-,6-/m1/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
12 names
- 1,3-Dioxolane-4,5-dicarboxylic acid, 2,2-dimethyl-, 4,5-dimethyl ester, (4R,5R)-
- 1,3-Dioxolane-4,5-dicarboxylic acid, 2,2-dimethyl-, dimethyl ester, (4R-trans)-
- 1,3-Dioxolane-4,5-dicarboxylic acid, 2,2-dimethyl-, dimethyl ester, (4R,5R)-
- Dimethyl 2,3-O-isopropylidene-L-tartrate
- (-)-Dimethyl-2,3-O-isopropylidene-L-tartrate
- Dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
- Dimethyl (4R,5R)-2,2,dimethyl-1,3-dioxolane-4,5-dicarboxylate
- (4R,5R)-2,2-Dimethyl-1,3-dioxolane-4,5-dicarboxylic acid dimethyl ester
- Dimethyl L-tartarte acetonide
- Dimethyl 2,3-O-isopropylidene L-tartrate
- 2,3-Di-O-isopropylidene-L-tartrate
- (2R,3R)-Dimethyl-2,3-O-isopropylidene tartrate
Work with 4,5-Dimethyl (4R,5R)-2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
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.
Similar compounds
2,3-O-Isopropylidene-D-glyceric acid methyl ester52373-72-555 % similar
Methyl (4S)-2,2-dimethyl-1,3-dioxolane-4-carboxylate60456-21-555 % similar
Methyl cyclopentanecarboxylate4630-80-245 % similar
Cyclobutanecarboxylic acid methyl ester765-85-545 % similar
Methyl isobutyrate547-63-744 % similar
Dimethyl methylmalonate609-02-944 % similar
Methyl cyclohexanecarboxylate4630-82-443 % similar
2,3-O-Isopropylidene-D-ribonolactone30725-00-943 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.