N-succinimidyl-2-methoxy 2-phenylacetic acid ester
Basic information
- CAS
122607-12-9- Standard SMILES
CO[C@H](C(=O)ON1C(=O)CCC1=O)c1ccccc1- InChIKey
HHVJDKXLUXCHRW-LBPRGKRZSA-N- Molecular formula
- C13H13NO5
- Average molar mass
- 263.25 g/mol
- Monoisotopic mass
- 263.07937252
Overview
an amine-directed chiral derivatizing reagent suitable for enzymatic scale resolutions; structure given in first source
Names & identifiers
- Preferred name
- N-succinimidyl-2-methoxy 2-phenylacetic acid ester
- IUPAC
- (2,5-dioxopyrrolidin-1-yl) (2S)-2-methoxy-2-phenylacetate
- English name
- N-succinimidyl-2-methoxy 2-phenylacetic acid ester
- Molecular formula
- C13H13NO5
- Molecular weight
- 263.24602
Names & synonyms
2-SmpaN-Succinimidyl-2-methoxy 2-phenylacetic acid ester122607-12-9DTXSID60153662RefChem:164214DTXCID70761532,5-Dioxopyrrolidin-1-yl (2S)-methoxy(phenyl)acetate2,5-Pyrrolidinedione, 1-((methoxyphenylacetyl)oxy)-, (S)-
Database identifiers
- CAS
122607-12-9- PubChem CID
- 129755
- DTXSID
DTXSID60153662
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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