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Basic information
- CAS
83123-75-5- Standard SMILES
CCOC(=O)CSc1n[nH]c(=S)s1- InChIKey
OAIGHLCSLWCUOV-UHFFFAOYSA-N- Molecular formula
- C6H8N2O2S3
- Average molar mass
- 236.343 g/mol
- Monoisotopic mass
- 235.9747905
Names & identifiers
- Preferred name
- AO-780/25081011
- IUPAC
- Ethyl [(5-sulfanylidene-4,5-dihydro-1,3,4-thiadiazol-2-yl)sulfanyl]acetate
- English name
- Acetic acid, [(4,5-dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)thio]-, ethyl ester
- Molecular formula
- C6H8N2O2S3
- Molecular weight
- 236.33
Names & synonyms
ETHYL (5-MERCAPTO-1,3,4-THIAZOL-2-YLTHIO)ACETATEEthyl 2-((5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)thio)acetate2-((5-Thioxo-4，5-dihydro-1，3，4-thiadiazol-2-yl)thio)ethyl acetateAcetic acid, [(4,5-dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)thio]-, ethyl esterAcetic acid, 2-[(4,5-dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)thio]-, ethyl ester
Database identifiers
- CAS
83123-75-5- PubChem CID
- 1201367
- DTXSID
DTXSID00360878- ChEMBL
CHEMBL1540295- Nikkaji
- J417.440B
Properties
Physicochemical properties
- Melting point
- 67 · 67-68 °C
- Boiling point
- 324.5 · 324.5±44.0 °C(Predicted)
- Density
- 1.56 · 1.56±0.1 g/cm3(Predicted)
- pka
- 5.25 · 5.25±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P301+P312-P302+P352-P304+P340-P305+P351+P338
Chemistry & industry
Suppliers10 total
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海拓目化工有限公司13391076197 · [email protected]
上海瀚思化工有限公司18916268197 · [email protected]
武汉赢元贝商贸有限公司86-13349903920 13349903920 · [email protected]
上海迈瑞尔生化科技有限公司18621169109 · [email protected]
济南光尘医药科技有限公司18563726319 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
上海捷世凯生物科技有限公司021-57520305 13795461237 · [email protected]
武汉万鉴生物科技有限公司13277087647 · [email protected]
合肥钼凯医药科技有限公司18001872185; 18001872185 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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