| CAS Number | 2055119-11-2 |
| Catalog Number | AG00I3WM(AGN-PC-0WR48W) |
| Chemical Name | Benzyl N-(5-methoxypyridin-2-yl)carbamate |
| IUPAC Name | benzyl N-(5-methoxypyridin-2-yl)carbamate |
| InChI | InChI=1S/C14H14N2O3/c1-18-12-7-8-13(15-9-12)16-14(17)19-10-11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,15,16,17) |
| InChI Key | CGXPYKQEYQYUBW-UHFFFAOYSA-N |
| MDL Number | MFCD30527680 |
| Molecular Formula | C14H14N2O3 |
| Molecular Weight | 258.2726 |
| SMILES | COc1ccc(nc1)NC(=O)OCc1ccccc1 |
| Synonyms | Benzyl N-(5-methoxypyridin-2-yl)carbamate,
2055119-11-2,
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| Complexity | 280 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 258.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 258.277g/mol |
| Monoisotopic Mass | 258.1g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 60.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
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