(R)-Glycidyl tosylate

C₁₀H₁₂O₄SCAS 113826-06-5228.26 g/mol

Open in Covalent MOL file

Epoxide Ether Sulfonate ester

Properties

Molecular formula: C₁₀H₁₂O₄S
Molar mass: 228.26 g/mol
Exact mass: 228.0456 Da
Melting point: 45–46 °C
logP: 1.10Crippen estimate
Polar surface area: 55.9 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 4
Stereocentres: Rin SMILES atom order

Hazards

Danger

H318 Causes serious eye damage97.6% of notifiers
H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled92.7% of notifiers
H350 May cause cancer97.6% of notifiers

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P203, P233, P260, P264+P265, P271, P280, P284, P304+P340, P305+P354+P338, P317, P318, P342+P316, P403, P405, P501

Identifiers

CAS number

113826-06-5

SMILES

Cc1ccc(S(=O)(=O)OC[C@H]2CO2)cc1

InChIKey

NOQXXYIGRPAZJC-SECBINFHSA-N

InChI

InChI=1S/C10H12O4S/c1-8-2-4-10(5-3-8)15(11,12)14-7-9-6-13-9/h2-5,9H,6-7H2,1H3/t9-/m1/s1

Weigh it out

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

Names and synonyms

16 names · show all

Glycidyl tosylate, (R)-
2-Oxiranemethanol, 2-(4-methylbenzenesulfonate), (2R)-
Oxiranemethanol, 4-methylbenzenesulfonate, (R)-
Oxiranemethanol, 4-methylbenzenesulfonate, (2R)-
(-)-Glycidyl tosylate
(R)-(-)-Glycidyl p-toluenesulfonate
(R)-Glycidol tosylate
R-(-)-Glycidyl tosylate
(2R)-(-)-Glycidyl tosylate
(R)-Oxiran-2-ylmethyl toluene-4-sulfonate
(R)-(-)-Oxiran-2-ylmethyl 4-methylbenzenesulfonate
(2R)-Glycidyl tosylate
4-Methylbenzyl (2R)-oxiran-2-ylmethanesulfonate
(R)-Oxiran-2-ylmethyl tosylate
[(2R)-Oxiran-2-yl]methyl 4-methylbenzenesulfonate
[(2R)-Oxiran-2-yl]methyl 4-methylbenzene-1-sulfonate

Work with (R)-Glycidyl tosylate

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.

(S)-Glycidyl tosylate70987-78-9Enantiomer

Similar compounds

(S)-2,2-Dimethyl-1,3-dioxolane-4-methanol P-toluenesulfonate23735-43-565 % similar (R)-(-)-2,2-Dimethyl-1,3-dioxolan-4-ylmethyl P-toluenesulfonate23788-74-165 % similar Ethylene glycol ditosylate6315-52-264 % similar Propane-1,2-diyl bis(4-methylbenzene-1-sulfonate)60434-71-163 % similar Propyl 4-methylbenzenesulfonate599-91-761 % similar (4S-Trans)-2,2-Dimethyl-4,5-bis[(4-methylphenylsulfonyloxy)methyl]-1,3-dioxolane37002-45-260 % similar (R)-Glycerol 1-(P-toluenesulfonate)41274-09-360 % similar (4R,5R)-4,5-Bis[[[(4-methylphenyl)sulfonyl]oxy]methyl]-2,2-dimethyl-[1,3]dioxolane51064-65-460 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Oxetan-3-yl 4-methylbenzene-1-sulfonate26272-83-3 Ethyl phenylsulfonylacetate7605-30-3 2-(3,4-Dimethoxyphenylthio)acetic acid95735-63-0

Elsewhere

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