Molecular properties
- Formula
- C8H7NS
- Molar mass
- 149.22 g·mol−1
- Exact mass
- 149.0299 Da
- 6
- PubChem CID
- 18272
Molecule record
4-methyl-1,3-benzothiazole
C8H7NS
149.22 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
- 3048-48-4
- 4-METHYLBENZOTHIAZOLE
- 4-methyl-Benzothiazole
- 4-methylbenzo[d]thiazole
- AS-92177
- Benzothiazole, 4-methyl-
- Benzothiazole, 4-methyl- (7CI,8CI,9CI)
- CS-0061214
Show all 22 synonyms
- DTXCID40107042
- DTXSID00184551
- F18224
- F603312
- MFCD11975739
- PIUXNZAIHQAHBY-UHFFFAOYSA-N
- RefChem:294556
- SCHEMBL211528
- SCHEMBL2595195
- SCHEMBL288903
- SCHEMBL288904
- SCHEMBL29967087
- SCHEMBL9588550
- SY069393
Structure identifiers
- Canonical SMILES
- Cc1cccc2scnc12
- Isomeric SMILES
- CC1=C2C(=CC=C1)SC=N2
- InChI
- InChI=1S/C8H7NS/c1-6-3-2-4-7-8(6)9-5-10-7/h2-5H,1H3
- InChIKey
- PIUXNZAIHQAHBY-UHFFFAOYSA-N
- PubChem CID
- 18272
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 4-methyl-1,3-benzothiazole; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 4-methyl-1,3-benzothiazole; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.