| CAS Number | 1260794-50-0 |
| Catalog Number | AG000RAY(AGN-PC-0WD2XU) |
| Chemical Name | tert-Butyl 5-fluoropyridin-2-ylcarbamate |
| IUPAC Name | tert-butyl N-(5-fluoropyridin-2-yl)carbamate |
| InChI | InChI=1S/C10H13FN2O2/c1-10(2,3)15-9(14)13-8-5-4-7(11)6-12-8/h4-6H,1-3H3,(H,12,13,14) |
| InChI Key | QJKDSHHDJJUUNY-UHFFFAOYSA-N |
| MDL Number | MFCD11976436 |
| Molecular Formula | C10H13FN2O2 |
| Molecular Weight | 212.2208 |
| SMILES | O=C(OC(C)(C)C)NC1=NC=C(F)C=C1 |
| Synonyms | 1260794-50-0,
tert-Butyl (5-fluoropyridin-2-yl)carbamate,
tert-butyl 5-fluoropyridin-2-ylcarbamate,
(5-fluoro-pyridin-2-yl)-carbamic acid tert-butyl ester,
DTXSID80856709,
ZINC71676416,
AKOS016591009,
FCH1628976,
QC-7877,
SC-62732,
AB0097059,
AJ-118426,
AX8259051,
Z-8168,
Carbamic acid, N-(5-fluoro-2-pyridinyl)-, 1,1-dimethylethyl ester,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.096g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.224g/mol |
| Monoisotopic Mass | 212.096g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 51.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number