Octanoic Acid N-Succinimidyl Ester - CAS 14464-30-3
Catalog: |
BB009814 |
Product Name: |
Octanoic Acid N-Succinimidyl Ester |
CAS: |
14464-30-3 |
Synonyms: |
octanoic acid (2,5-dioxo-1-pyrrolidinyl) ester; (2,5-dioxopyrrolidin-1-yl) octanoate |
IUPAC Name: | (2,5-dioxopyrrolidin-1-yl) octanoate |
Description: | Octanoic Acid N-Succinimidyl Ester (CAS# 14464-30-3) is used in preparation of eliglustat and tartrate thereof. |
Molecular Weight: | 241.28 |
Molecular Formula: | C12H19NO4 |
Canonical SMILES: | CCCCCCCC(=O)ON1C(=O)CCC1=O |
InChI: | InChI=1S/C12H19NO4/c1-2-3-4-5-6-7-12(16)17-13-10(14)8-9-11(13)15/h2-9H2,1H3 |
InChI Key: | PEJVSXYBFAVPAQ-UHFFFAOYSA-N |
MDL: | MFCD00050404 |
LogP: | 1.89200 |
Publication Number | Title | Priority Date |
WO-2020194138-A1 | An improved process for the preparation of eliglustat and its intermediate | 20190322 |
CN-110878079-A | Preparation method of high-purity eliagliptat | 20181231 |
CN-111217791-A | Ibrustat intermediate and preparation method thereof | 20181127 |
WO-2020020365-A1 | Method for preparing optically active eliglustat | 20180727 |
WO-2020004535-A1 | Sensor chip for high-sensitivity detection of cells, etc. | 20180628 |
Complexity: | 285 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.13140809 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.13140809 |
Rotatable Bond Count: | 8 |
Topological Polar Surface Area: | 63.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.2 |
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