Basic information
- CAS
56421-61-5- Standard SMILES
CC(=O)c1sc(-c2cccs2)nc1C- InChIKey
GRYWITIQEPSTMV-UHFFFAOYSA-N- Molecular formula
- C10H9NOS2
- Average molar mass
- 223.3 g/mol
- Monoisotopic mass
- 223.01255591
Names & identifiers
- Preferred name
- 1-[4-Methyl-2-(2-thienyl)-1,3-thiazol-5-yl]-1-ethanone
- IUPAC
- 1-(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)ethanone
- English name
- 1-[4-Methyl-2-(2-thienyl)-1,3-thiazol-5-yl]-1-ethanone
- Molecular formula
- C10H9NOS2
- Molecular weight
- 223.31
Names & synonyms
56421-61-51-[4-methyl-2-(2-thienyl)-1,3-thiazol-5-yl]-1-ethanone1-(4-Methyl-2-(thiophen-2-yl)thiazol-5-yl)ethanone1-(4-methyl-2-thiophen-2-yl-1,3-thiazol-5-yl)ethanoneMFCD001120841-[4-methyl-2-(thiophen-2-yl)-1,3-thiazol-5-yl]ethan-1-one1-[4-methyl-2-(2-thienyl)-1,3-thiazol-5-yl]ethan-1-oneSCHEMBL2881411-(4-methyl-2-thiophen-2-yl-thiazol-5-yl)-ethanoneDTXSID10372523GRYWITIQEPSTMV-UHFFFAOYSA-NAKOS001297501
Show more names
Ethanone, 1-[4-methyl-2-(2-thienyl)-5-thiazolyl]-
DA-31728AB00758683-011-[4-methyl-2-(2-thienyl)thiazol-5-yl]ethanone7R-08061-(4-methyl-2-thiophen-2-yl-thiazol-5-yl)ethanoneZ48863098
Database identifiers
- CAS
56421-61-5- PubChem CID
- 2744245
- DTXSID
DTXSID10372523
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 86.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 234
Physicochemical properties
- Melting point
- 121 °C · 121 °C
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- risk_code
- 22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers9 total
广州伟伯科技有限公司[email protected]
Carbone Scientific CO., LTD[email protected]
Ryan Scientific, Inc.[email protected]
BIONET-INTER[email protected]
MAYBR-INT—
深圳爱拓化学有限公司0755- 33239182 · [email protected]
Service Chemical Inc.[email protected]
SIGMAALDRICH—
3B Scientific Corporation[email protected]
Related reactions
10 records
Compound notes
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