Molecular properties
- Formula
- C8H10O3S
- Molar mass
- 186.23 g·mol−1
- Exact mass
- 186.0351 Da
- 4
- PubChem CID
- 6645
Molecule record
methyl 4-methylbenzenesulfonate
C8H10O3S
186.23 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- ((2)H1,(3)H)methyl tosylate
- 201-283-5
- 4-Toluenesulfonic acid, methyl ester
- 4SU69KI68L
- 80-48-8
- Benzenesulfonic acid, 4-methyl-, methyl ester
- DTXCID1031123
- DTXSID4052550
Show all 24 synonyms
- METHYL P-METHYLBENZENESULFONATE
- Methyl 4-toluene sulfonate
- Methyl p-toluenesulfonate
- Methyl p-tosylate
- Methyl toluene sulfonate
- Methyl toluene-4-sulfonate
- Methyl toluene-4-sulphonate
- Methyl toluenesulfonate
- Methyl tosylate
- Methylester kyseliny p-toluensulfonove
- NSC-406335
- RefChem:157983
- methyl p-toluene sulfonate
- p-Methylbenzenesulfonate methyl ester
- p-Toluenesulfonic acid, methyl ester
- p-Toluolsulfonsaeure methyl ester
Structure identifiers
- Canonical SMILES
- COS(=O)(=O)c1ccc(C)cc1
- Isomeric SMILES
- CC1=CC=C(C=C1)S(=O)(=O)OC
- InChI
- InChI=1S/C8H10O3S/c1-7-3-5-8(6-4-7)12(9,10)11-2/h3-6H,1-2H3
- InChIKey
- VUQUOGPMUUJORT-UHFFFAOYSA-N
- PubChem CID
- 6645
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for methyl 4-methylbenzenesulfonate; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for methyl 4-methylbenzenesulfonate; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.