| CAS Number | 906745-11-7 |
| Catalog Number | AG00IG9E(AGN-PC-0WRAAD) |
| Chemical Name | tert-Butyl N-(5-hydroxypyridin-3-yl)carbamate |
| IUPAC Name | tert-butyl N-(5-hydroxypyridin-3-yl)carbamate |
| InChI | InChI=1S/C10H14N2O3/c1-10(2,3)15-9(14)12-7-4-8(13)6-11-5-7/h4-6,13H,1-3H3,(H,12,14) |
| InChI Key | NMNLEGGOBKZYGQ-UHFFFAOYSA-N |
| MDL Number | MFCD22381909 |
| Molecular Formula | C10H14N2O3 |
| Molecular Weight | 210.2298 |
| SMILES | O=C(OC(C)(C)C)Nc1cncc(c1)O |
| Synonyms | tert-butyl N-(5-hydroxypyridin-3-yl)carbamate,
906745-11-7,
SCHEMBL12735928,
tert-butyl(5-hydroxypyridin-3-yl)carbamate,
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| Complexity | 225 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.1g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.233g/mol |
| Monoisotopic Mass | 210.1g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 71.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
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