Benzoic acid, 2-(dimethylsulfamoyl)-5-methoxy-, methyl ester
Basic information
- CAS
74131-18-3- Standard SMILES
COC(=O)c1cc(OC)ccc1S(=O)(=O)N(C)C- InChIKey
PIOMLKAIMMZDSS-UHFFFAOYSA-N- Molecular formula
- C11H15NO5S
- Average molar mass
- 273.31 g/mol
- Monoisotopic mass
- 273.06709375
Names & identifiers
- Preferred name
- Benzoic acid, 2-(dimethylsulfamoyl)-5-methoxy-, methyl ester
- IUPAC
- methyl 2-(dimethylsulfamoyl)-5-methoxybenzoate
Names & synonyms
BRN 5065832BENZOIC ACID, 2-(DIMETHYLSULFAMOYL)-5-METHOXY-, METHYL ESTERMethyl 5-methoxy-2-(dimethylsulfamoyl)benzoate74131-18-3DTXSID90225088RefChem:326803DTXCID90147579methyl 2-(dimethylsulfamoyl)-5-methoxybenzoate
Database identifiers
- CAS
74131-18-3- PubChem CID
- 52932
- DTXSID
DTXSID90225088- Nikkaji
- J83.378I
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 81.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 387
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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