Basic information
- CAS
820214-08-2- Standard SMILES
COc1cc(Cl)cc2c1NC(=O)NS2(=O)=O- InChIKey
YIMAAXJOHOYGOE-UHFFFAOYSA-N- Molecular formula
- C8H7ClN2O4S
- Average molar mass
- 262.67 g/mol
- Monoisotopic mass
- 261.9815056
Names & identifiers
- Preferred name
- 2H-1,2,4-Benzothiadiazin-3(4H)-one, 7-chloro-5-methoxy-, 1,1-dioxide
- IUPAC
- 7-chloro-5-methoxy-1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-one
- English name
- 2H-1,2,4-Benzothiadiazin-3(4H)-one, 7-chloro-5-methoxy-, 1,1-dioxide
- Molecular formula
- C8H7ClN2O4S
- Molecular weight
- 262.67018
Names & synonyms
820214-08-22H-1,2,4-Benzothiadiazin-3(4H)-one, 7-chloro-5-methoxy-, 1,1-dioxide7-Chloro-5-methoxy-2H-benzo[e][1,2,4]thiadiazin-3(4H)-one 1,1-dioxideMFCD316673847-chloro-5-methoxy-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-1,1,3-trione7-chloro-5-methoxy-1,1-dioxo-4H-1lambda6,2,4-benzothiadiazin-3-oneSCHEMBL4648066DTXSID70461689YIMAAXJOHOYGOE-UHFFFAOYSA-NVHB21408CS-0069971D87067
Show more names
7-chloro-5-methoxy-1,1-dioxo-4H-1λ6,2,4-benzothiadiazin-3-one
EN300-64736772H-1,2,4-Benzothiadiazin-3(4H)-one,7-chloro-5-methoxy-,1,1-dioxide7-chloro-5-(methyloxy)-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide7-Chloro-5-methoxy-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione7-Chloro-5-methoxy-2H-1,2,4-benzothiadiazin-3(4H)-one 1,1-dioxide7-chloro-5-methoxy-3,4-dihydro-2H-1|E?,2,4-benzothiadiazine-1,1,3-trione
Database identifiers
- CAS
820214-08-2
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 92.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 393
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-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
- P280-P305+P351+P338
Chemistry & industry
Suppliers3 total
深圳市创鑫生物科技有限公司13417589054 · [email protected]
深圳市创鑫生物科技有限公司13417589054 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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