| CAS Number | 1198186-15-0 |
| Catalog Number | AG00HF4P(AGN-PC-0WQWYB) |
| Chemical Name | N-Boc-3-fluoro-D-tyrosine |
| IUPAC Name | (2R)-3-(3-fluoro-4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid |
| InChI | InChI=1S/C14H18FNO5/c1-14(2,3)21-13(20)16-10(12(18)19)7-8-4-5-11(17)9(15)6-8/h4-6,10,17H,7H2,1-3H3,(H,16,20)(H,18,19)/t10-/m1/s1 |
| InChI Key | PIDYYTCMUSVKTJ-SNVBAGLBSA-N |
| MDL Number | MFCD08689608 |
| Molecular Formula | C14H18FNO5 |
| Molecular Weight | 299.2948 |
| SMILES | FC1C(=CC=C(C=1)C[C@H](C(O)=O)NC(=O)OC(C)(C)C)O |
| Synonyms | N-Boc-3-fluoro-D-tyrosine,
1198186-15-0,
(r)-2-tert-butoxycarbonylamino-3-(3-fluoro-4-hydroxyphenyl)propionic acid,
SCHEMBL1429759,
DTXSID00654385,
PIDYYTCMUSVKTJ-SNVBAGLBSA-N,
ZINC2583004,
MFCD08689608,
AS-36972,
N-(tert-Butoxycarbonyl)-3-fluoro-D-tyrosine,
(R)-2-tert-Butoxycarbonylamino-3-(3-fluoro-4-hydroxy-phenyl)-propionic acid,
|
| Complexity | 382 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 299.117g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 299.298g/mol |
| Monoisotopic Mass | 299.117g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number