Basic information
- CAS
346696-73-9- Standard SMILES
COC(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C- InChIKey
ROAWGCLLOBYJBG-UHFFFAOYSA-N- Molecular formula
- C12H17NO4S
- Average molar mass
- 271.33 g/mol
- Monoisotopic mass
- 271.0878292
Names & identifiers
- Preferred name
- N-[(2,4,6-Trimethylphenyl)sulfonyl]glycine methyl ester
- IUPAC
- methyl 2-[(2,4,6-trimethylphenyl)sulfonylamino]acetate
Names & synonyms
346696-73-9N-[(2,4,6-Trimethylphenyl)sulfonyl]glycine methyl esterN-((2,4,6-Trimethylphenyl)sulfonyl)glycine methyl esterRefChem:359567Methyl N-(2,4,6-trimethylbenzene-1-sulfonyl)glycinateOprea1_011071Oprea1_654521DTXSID801204520STK073808AKOS000673537ST042714methyl N-[(2,4,6-trimethylphenyl)sulfonyl]glycinate
Show more names
methyl 2-{[(2,4,6-trimethylphenyl)sulfonyl]amino}acetate
Database identifiers
- CAS
346696-73-9- PubChem CID
- 669142
- DTXSID
DTXSID801204520
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 80.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 375
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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