Ethyl 2-(1-Boc-3-pyrrolidyl)acetate - CAS 664364-29-8
Catalog: |
BB033034 |
Product Name: |
Ethyl 2-(1-Boc-3-pyrrolidyl)acetate |
CAS: |
664364-29-8 |
Synonyms: |
3-(2-ethoxy-2-oxoethyl)-1-pyrrolidinecarboxylic acid tert-butyl ester; tert-butyl 3-(2-ethoxy-2-oxoethyl)pyrrolidine-1-carboxylate |
IUPAC Name: | tert-butyl 3-(2-ethoxy-2-oxoethyl)pyrrolidine-1-carboxylate |
Description: | Ethyl 2-(1-Boc-3-pyrrolidyl)acetate (CAS# 664364-29-8) is a useful research chemical. |
Molecular Weight: | 257.33 |
Molecular Formula: | C13H23NO4 |
Canonical SMILES: | CCOC(=O)CC1CCN(C1)C(=O)OC(C)(C)C |
InChI: | InChI=1S/C13H23NO4/c1-5-17-11(15)8-10-6-7-14(9-10)12(16)18-13(2,3)4/h10H,5-9H2,1-4H3 |
InChI Key: | PIDOQUSXCYDMQD-UHFFFAOYSA-N |
MDL: | MFCD11977331 |
LogP: | 2.13450 |
Publication Number | Title | Priority Date |
WO-2020146613-A1 | Kras g12c inhibitors | 20190110 |
AU-2018377993-A1 | Pyrazolopyrimidines having activity against the respiratory syncytial virus (rsv) | 20171129 |
CA-3079126-A1 | Pyrazolopyrimidines having activity against the respiratory syncytial virus (rsv) | 20171129 |
WO-2019106004-A1 | Pyrazolopyrimidines having activity against the respiratory syncytial virus (rsv) | 20171129 |
CN-111417635-A | Pyrazolopyrimidines having activity against Respiratory Syncytial Virus (RSV) | 20171129 |
Complexity: | 309 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.16270821 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.16270821 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 55.8 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.7 |
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