Basic information
- CAS
175277-53-9- Standard SMILES
O=Cc1c(Sc2ccc(Cl)cc2)nc2sccn12- InChIKey
LVNVTDKIAXLVOY-UHFFFAOYSA-N- Molecular formula
- C12H7ClN2OS2
- Average molar mass
- 294.8 g/mol
- Monoisotopic mass
- 293.9688329
Names & identifiers
- Preferred name
- 6-[(4-Chlorophenyl)sulfanyl]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
- IUPAC
- 6-(4-chlorophenyl)sulfanylimidazo[2,1-b][1,3]thiazole-5-carbaldehyde
- English name
- 6-[(4-Chlorophenyl)thio]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde
- Molecular formula
- C12H7ClN2OS2
- Molecular weight
- 294.78
Names & synonyms
175277-53-96-[(4-chlorophenyl)sulfanyl]imidazo[2,1-b][1,3]thiazole-5-carbaldehyde6-((4-Chlorophenyl)thio)imidazo[2,1-b]thiazole-5-carbaldehyde6-[(4-CHLOROPHENYL)THIO]IMIDAZO[2,1-B][1,3]THIAZOLE-5-CARBALDEHYDEMFCD001025856-(4-chlorophenyl)sulfanylimidazo[2,1-b][1,3]thiazole-5-carbaldehydeC12H7ClN2OS2DTXSID50384105AKOS000135948CS-03241518D-0696-(4-chlorophenyl)sulfanylimidazo[2,1-b]thiazole-5-carbaldehyde
Show more names
6-(4-CHLOROPHENYLTHIO)IMIDAZO[2,1-B]THIAZOLE-5-CARBOXALDEHYDEImidazo[2,1-b]thiazole-5-carboxaldehyde, 6-[(4-chlorophenyl)thio]-
6-[(4-Chlorophenyl)thio]imidazo-[2,1-b][1,3]thiazole-5-carbaldehyde6-[(4-chlorophenyl)thio]imidazo[2,1-b][1,3]thiazole-5-carboxaldehyde
Database identifiers
- CAS
175277-53-9
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 87.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Physicochemical properties
- Melting point
- 139 · 139-141°C
- Density
- 1.54 · 1.54±0.1 g/cm3(Predicted)
- pka
- 1.65 · 1.65±0.40(Predicted)
- 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
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 2934999090 · 2934999090
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
- hs_code
- 2934999090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers5 total
宁波振岳医药科技有限公司19817745290 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
常州合晶化工有限公司85528066 13775048983 · [email protected]
宁波振岳医药科技有限公司0086-19817745290; 19817745290 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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