| CAS Number | 1824423-52-0 |
| Catalog Number | AG01C2HF |
| Chemical Name | tert-butyl N-[2-(4-fluorophenyl)-3-hydroxypropyl]carbamate |
| IUPAC Name | tert-butyl N-[2-(4-fluorophenyl)-3-hydroxypropyl]carbamate |
| InChI | InChI=1S/C14H20FNO3/c1-14(2,3)19-13(18)16-8-11(9-17)10-4-6-12(15)7-5-10/h4-7,11,17H,8-9H2,1-3H3,(H,16,18) |
| InChI Key | XFLCSUFZDRUSSK-UHFFFAOYSA-N |
| MDL Number | MFCD24543095 |
| Molecular Formula | C14H20FNO3 |
| Molecular Weight | 269.3119 |
| SMILES | CC(OC(NCC(C1=CC=C(F)C=C1)CO)=O)(C)C |
| Synonyms | 1824423-52-0,
tert-butyl N-[2-(4-fluorophenyl)-3-hydroxypropyl]carbamate,
|
| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 269.143g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 269.316g/mol |
| Monoisotopic Mass | 269.143g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 58.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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