Basic information
- CAS
5423-64-3- Standard SMILES
S=C(Cc1cccnc1)N1CCOCC1- InChIKey
GTBVCLWBSABWPA-UHFFFAOYSA-N- Molecular formula
- C11H14N2OS
- Average molar mass
- 222.31 g/mol
- Monoisotopic mass
- 222.08268425
Names & identifiers
- Preferred name
- 1-(4-Morpholinyl)-2-(3-pyridinyl)ethanethione
- IUPAC
- 1-morpholin-4-yl-2-pyridin-3-ylethanethione
- English name
- 1-Morpholino-2-(3-pyridinyl)ethanethione
- Molecular formula
- C11H14N2OS
- Molecular weight
- 222.31
Names & synonyms
5423-64-3Morpholine, 4-(3-pyridylthioacetyl)-LGQ9KUA8GCNSC-13221NSC-41709DTXSID402025811-(4-Morpholinyl)-2-(3-pyridinyl)ethanethioneRefChem:1054454DTXCID701250724-(3-Pyridylthioacetyl)morpholine1-morpholin-4-yl-2-pyridin-3-ylethanethioneMorpholine, 4- (3-pyridylthioacetyl)-
Show more names
Risedronate Impurity 10(pyridin-3-yl)thioacetmorpholide1-Morpholino-2-(3-pyridinyl)ethanethione1-MORPHOLIN-4-YL-2-PYRIDIN-3-YL-ETHANETHIONEEthanethione, 1-(4-morpholinyl)-2-(3-pyridinyl)-
1-Morpholino-2-(pyridin-3-yl)ethane-1-thione1-(morpholin-4-yl)-2-(pyridin-3-yl)ethane-1-thione4-[2-(3-pyridinyl)ethanethioyl]morpholine1-morpholin-4-yl-2-(3-pyridyl)ethane-1-thioneWLN: T6N DOTJ AYUS&1- CT6NJNSC 13221Morpholino-3-pyridylmethylthioneNSC 41709
Database identifiers
- CAS
5423-64-3- PubChem CID
- 95002
- DTXSID
DTXSID40202581
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 217
Physicochemical properties
- Melting point
- 78.5 · 78.5-79.5 °C(Solv: benzene (71-43-2); ligroine (8032-32-4))
- Boiling point
- 377.7 · 377.7±52.0 °C(Predicted)
- Density
- 1.224 · 1.224±0.06 g/cm3(Predicted)
- pka
- 4.86 · 4.86±0.10(Predicted)
- FDA UNII
- 9 KUA8GC · LGQ9KUA8GC
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers9 total
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
泰州市众致生物科技有限公司[email protected] 15066129350 · [email protected]
郑州安步防护用具有限公司+86-0371-88006763; +86-15988602810 · [email protected]
上海逐耀医药科技有限公司18321033991 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
海蔚化学86-21-51086038 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
宝鸡缔都医药化工有限公司029-029-81148929 17792602132 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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