Basic information
- CAS
2044-27-1- Standard SMILES
Cn1ccccc1=S- InChIKey
UHOAUPKGWPQNDM-UHFFFAOYSA-N- Molecular formula
- C6H7NS
- Average molar mass
- 125.19 g/mol
- Monoisotopic mass
- 125.02992022
Names & identifiers
- Preferred name
- 1-Methyl-2(1H)-pyridinethione
- IUPAC
- 1-methylpyridine-2-thione
- English name
- 1-methylpyridine-2-thione
- Molecular formula
- C6H7NS
- Molecular weight
- 125.19
Names & synonyms
N-Methyl-2-pyridinethione2044-27-11-Methyl-2(1H)-pyridinethione1-Methyl-2-pyridinethione2(1H)-PYRIDINETHIONE, 1-METHYL-8MG7JSX8JGNSC-157922RefChem:10557431-Methyl-2-thiopyridone1-methylpyridine-2(1H)-thione1-methylpyridine-2-thioneN-Methylthiopyridone-2
Show more names
1-Methyl-2-thioxopyridine1-Methyl-1,2-dihydropyridine-2-thione
1-methylhydropyridine-2-thioneN-Methylthiopyridone-2 [French]NSC 157922BRN 0107807NSC157922UNII-8MG7JSX8JG5-21-07-00148 (Beilstein Handbook Reference)N-methyl-1h-pyridine-2-thione
Database identifiers
- CAS
2044-27-1、6887-59-8- PubChem CID
- 16277
- DTXSID
DTXSID60870923- UNII
- 8MG7JSX8JG
- Nikkaji
- J66.623H
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 35.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 158
Experimental & physicochemical properties
SpringerMaterials PropertiesChemical shift
Physicochemical properties
- FDA UNII
- 8 MG7JSX8JG · 8MG7JSX8JG
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers4 total
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
上海澜克医药科技有限公司021-52216295 lankepharma
湖北扬信医药科技有限公司15374522761 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
Related reactions
32 records
Compound notes
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