| CAS Number | 1157206-28-4 |
| Catalog Number | AG01A9W8 |
| Chemical Name | Methyl 5-{[(2-ethoxyethyl)amino]methyl}furan-2-carboxylate |
| IUPAC Name | methyl 5-[(2-ethoxyethylamino)methyl]furan-2-carboxylate |
| InChI | InChI=1S/C11H17NO4/c1-3-15-7-6-12-8-9-4-5-10(16-9)11(13)14-2/h4-5,12H,3,6-8H2,1-2H3 |
| InChI Key | UHFDJSLTBWSVSY-UHFFFAOYSA-N |
| MDL Number | MFCD12056372 |
| Molecular Formula | C11H17NO4 |
| Molecular Weight | 227.2570 |
| SMILES | CCOCCNCC1OC(C(OC)=O)=CC=1 |
| Synonyms | methyl 5-{[(2-ethoxyethyl)amino]methyl}furan-2-carboxylate,
1157206-28-4,
AC1Q388F,
ZINC37269357,
AKOS008139729,
MCULE-9403812912,
NE48391,
EN300-66348,
Z1263529775,
|
| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 227.116g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 227.26g/mol |
| Monoisotopic Mass | 227.116g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 60.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
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Certificate of Analysis
Lot Number