Basic information
- CAS
157459-71-7- Standard SMILES
O=Cc1cn2c(n1)SCC2- InChIKey
JSUDYMLJEPHJCU-UHFFFAOYSA-N- Molecular formula
- C6H6N2OS
- Average molar mass
- 154.19 g/mol
- Monoisotopic mass
- 154.02008399
Names & identifiers
- Preferred name
- 2,3-Dihydroimidazo[2,1-b][1,3]thiazole-6-carbaldehyde
- IUPAC
- 2,3-dihydroimidazo[2,1-b][1,3]thiazole-6-carbaldehyde
- English name
- Imidazo[2,1-b]thiazole-6-carboxaldehyde, 2,3-dihydro- (9CI)
- Molecular formula
- C6H6N2OS
- Molecular weight
- 154.19
Names & synonyms
157459-71-72,3-dihydroimidazo[2,1-b][1,3]thiazole-6-carbaldehyde2,3-Dihydroimidazo[2,1-b]thiazole-6-carbaldehydeMFCD11553079Imidazo[2,1-b]thiazole-6-carboxaldehyde, 2,3-dihydro- (9CI)SCHEMBL925818DTXSID80459719JSUDYMLJEPHJCU-UHFFFAOYSA-NSBB087022AKOS005073661SS-29822,3-Dihydroimidazo[2,1-b]thiazole-6-carboxaldehyde
Show more names
Imidazo[2,1-b]thiazole-6-carboxaldehyde, 2,3-dihydro-
2,3-Dihydroimidazo[2,1-b]thiazole-6carboxaldehyde2H,3H-imidazo[2,1-b]1,3-thiazolidine-6-carbaldehyde2,3-dihydroimidazo[2,1-b][1,3]thiazole-6-carboxaldehyde
Database identifiers
- CAS
157459-71-7- PubChem CID
- 11240604
- DTXSID
DTXSID80459719- Nikkaji
- J2.090.109H
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 60.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 153
Physicochemical properties
- Boiling point
- 383.4 · 383.4±34.0 °C(Predicted)
- Density
- 1.55 · 1.55±0.1 g/cm3(Predicted)
- pka
- 2.05 · 2.05±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
Safety & regulation
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Suppliers2 total
杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 17714375163 · [email protected]
Related reactions
13 records
Compound notes
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