Methyl N-(2-methoxy-5-methylphenyl)-N-(methylsulfonyl)glycinate
Basic information
- CAS
425616-95-1- Standard SMILES
COC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O- InChIKey
WENXBAUUFPUETB-UHFFFAOYSA-N- Molecular formula
- C12H17NO5S
- Average molar mass
- 287.33 g/mol
- Monoisotopic mass
- 287.08274382
Names & identifiers
- Preferred name
- Methyl N-(2-methoxy-5-methylphenyl)-N-(methylsulfonyl)glycinate
- IUPAC
- methyl 2-(2-methoxy-5-methyl-N-methylsulfonylanilino)acetate
Names & synonyms
425616-95-1Methyl N-(2-methoxy-5-methylphenyl)-N-(methylsulfonyl)glycinatemethyl 2-(2-methoxy-5-methyl-N-methylsulfonylanilino)acetateglycine, N-(2-methoxy-5-methylphenyl)-N-(methylsulfonyl)-, methyl esterMETHYL 2-[N-(2-METHOXY-5-METHYLPHENYL)METHANESULFONAMIDO]ACETATECDS1_003633CBMicro_011057DivK1c_004673DTXSID901163139ALBB-029116SMSF0017680AKOS003206286
Show more names
CB14119LS-10144BIM-0010939.P001ST51015707H44384AB00104336-01AG-690/15440720SR-01000230693
Database identifiers
- CAS
425616-95-1- PubChem CID
- 846489
- DTXSID
DTXSID901163139
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 81.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 403
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Related reactions
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Compound notes
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