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Basic information
- CAS
31645-94-0- Standard SMILES
CC(=O)C1=C(C)Nc2ccccc2S1- InChIKey
WBZVLPUFAVZNKB-UHFFFAOYSA-N- Molecular formula
- C11H11NOS
- Average molar mass
- 205.282 g/mol
- Monoisotopic mass
- 205.05613497
Names & identifiers
- Preferred name
- 1-(3-Methyl-4H-1,4-benzothiazin-2-yl)ethan-1-one
- IUPAC
- 1-(3-Methyl-4H-1,4-benzothiazin-2-yl)ethan-1-one
- English name
- 1-(3-Methyl-4H-1,4-benzothiazin-2-yl)ethan-1-one
- Molecular formula
- C11H11NOS
- Molecular weight
- 205.28
Names & synonyms
2-ACETYL-3-METHYL-4H-1,4-BENZTHIAZINE2-ACETYL-3-METHYL-4H-1,4-BENZOTHIAZINE1-(3-METHYL-4H-1,4-BENZOTHIAZIN-2-YL)ETHANONE1-(3-Methyl-4H-1,4-benzothiazin-2-yl)ethan-1-oneEthanone, 1-(3-methyl-4H-1,4-benzothiazin-2-yl)-
Database identifiers
- CAS
31645-94-0- PubChem CID
- 595774
- DTXSID
DTXSID00344294- Nikkaji
- J1.457.770J
Properties
Physicochemical properties
- Melting point
- 194 · 194-195°C
- Boiling point
- 325.8 · 325.8±42.0 °C(Predicted)
- Density
- 1.191 · 1.191±0.06 g/cm3(Predicted)
- pka
- -0.93 · -0.93±0.60(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36/37/39
- HS Code
- 2934999090 · 2934999090
Safety & regulation
Safety data
- hs_code
- 2934999090
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 26-36/37/39
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers4 total
Ryan Scientific, Inc.[email protected]
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
MOLEKULA[email protected]
OuchiShinko Chemical Industrial Co., Ltd[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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