| CAS Number | 1823271-85-7 |
| Catalog Number | AG019EY5(AGN-PC-0WG4TN) |
| Chemical Name | 5-tert-Butyl 3-ethyl 4H-furo[2,3-c]pyrrole-3,5(6H)-dicarboxylate |
| IUPAC Name | 5-O-tert-butyl 3-O-ethyl 4,6-dihydrofuro[2,3-c]pyrrole-3,5-dicarboxylate |
| InChI | InChI=1S/C14H19NO5/c1-5-18-12(16)10-8-19-11-7-15(6-9(10)11)13(17)20-14(2,3)4/h8H,5-7H2,1-4H3 |
| InChI Key | ARHHBBXIFNNVGH-UHFFFAOYSA-N |
| MDL Number | MFCD27997349 |
| Molecular Formula | C14H19NO5 |
| Molecular Weight | 281.3044 |
| SMILES | CCOC(=O)c1coc2CN(Cc12)C(=O)OC(C)(C)C |
| Synonyms | 1823271-85-7,
5-tert-Butyl 3-ethyl 4H-furo[2,3-c]pyrrole-3,5(6H)-dicarboxylate,
MFCD27997349,
ZINC97759006,
AKOS027430114,
CS-0036826,
5-t-Butyl 3-ethyl 4H-furo[2,3-c]pyrrole-3,5(6H)-dicarboxylate,
5-(tert-Butyl) 3-ethyl 4,6-dihydro-5H-furo[2,3-c]pyrrole-3,5-dicarboxylate,
5-Tert-Butyl 3-Ethyl 4H-Furo[2,3-C]Pyrrole-3,5(6H)-Dicarboxylate(WX141815),
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| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 281.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 281.308g/mol |
| Monoisotopic Mass | 281.126g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 69A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
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Certificate of Analysis
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