Basic information
- CAS
2884-13-1- Standard SMILES
CSc1cncc(C)n1- InChIKey
UWZQTYQYHJLIRS-UHFFFAOYSA-N- Molecular formula
- C6H8N2S
- Average molar mass
- 140.21 g/mol
- Monoisotopic mass
- 140.04081944
Names & identifiers
- Preferred name
- 2-Methyl-6-(methylthio)pyrazine
- IUPAC
- 2-methyl-6-methylsulfanylpyrazine
- English name
- 2-Methylthio-6-methylpyrazine
- Molecular formula
- C6H8N2S
- Molecular weight
- 140.21
Names & synonyms
2-Methyl-6-(methylthio)pyrazine2-Methylthio-6-methylpyrazinePyrazine, 2-methyl-6-(methylthio)-2-Methyl-6-(methylsulfanyl)pyrazine2-Methyl-6-methylsulfanyl-pyrazineUNII-9821YQG3NEFEMA no. 3208, 6-(methylthio)-9821YQG3NEDTXSID60183040RefChem:88203DTXCID70105531UWZQTYQYHJLIRS-UHFFFAOYSA-N
Show more names
(3,5OR6)-(METHYLTHIO)-2-METHYLPYRAZINE2-methylthio-6-methylpyrazine USP/EP/BP
2884-13-12-methyl-6-methylsulfanylpyrazineCHEMBL327251SCHEMBL23882612SCHEMBL29664757AKOS0062718132-Methyl-6-(methylsulfanyl)pyrazine #NS00125844
Database identifiers
- CAS
2884-13-1、2884-14-2- PubChem CID
- 520398
- DTXSID
DTXSID60183040- ChEMBL
CHEMBL327251- UNII
- 9821YQG3NE
- Nikkaji
- J110.564G
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 87.1
Physicochemical properties
- Boiling point
- 84 · 84-88 °C(Press: 10 Torr)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- FEMA
- 3208 · 3208 | (METHYLTHIO)METHYLPYRAZINE (MIXTURE OF ISOMERS)
- storage temp.
- 2 · 2-8°C
- pka
- 0.46 · 0.46±0.10(Predicted)
- JECFA Number
- 797 · 797
- LogP
- 1.72 · 1.720
- FDA UNII
- 9821 YQG3NE · 9821YQG3NE
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPyrazine, 2-methyl-6-(methylthio)-: Does not have an individual approval but may be used under an appropriate group standard
Chemistry & industry
Pharmacology
Cellular LocationsCytoplasm
Applications
Uses2-Methyl-6-(methylthio)pyrazine can be used for the quantitative structure-property study on pyrazines with bell pepper aroma.
Suppliers8 total
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
陕西缔都医药化工有限公司+86-29-81139210 +86-17392587031 · [email protected]
BOC Sciences[email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
苏州诺欧曼生物科技有限公司15026866316 · [email protected]
兰州康寓信生物科技有限公司0943-8293106 · [email protected]
广东翁江化学试剂有限公司0751-2815983 13927872582 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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