| CAS Number | 1433975-21-3 |
| Catalog Number | AG009IT1 |
| Chemical Name | FMoc-D-4-Aph(tBu-CbM)-OH |
| IUPAC Name | (2R)-3-[4-(tert-butylcarbamoylamino)phenyl]-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid |
| InChI | InChI=1S/C29H31N3O5/c1-29(2,3)32-27(35)30-19-14-12-18(13-15-19)16-25(26(33)34)31-28(36)37-17-24-22-10-6-4-8-20(22)21-9-5-7-11-23(21)24/h4-15,24-25H,16-17H2,1-3H3,(H,31,36)(H,33,34)(H2,30,32,35)/t25-/m1/s1 |
| InChI Key | ZDEKLTOYUSVJAK-RUZDIDTESA-N |
| MDL Number | MFCD30475854 |
| Molecular Formula | C29H31N3O5 |
| Molecular Weight | 501.5735 |
| SMILES | O=C(O)[C@H](NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)CC4=CC=C(NC(NC(C)(C)C)=O)C=C4 |
| Synonyms | 1433975-21-3,
FMoc-D-4-Aph(tBu-CbM)-OH,
AKOS030525171,
Fmoc-D-Aph(tBuCbm)-OH,
fmoc-d-aminophenylalanine(cbm/tbu)-oh,
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| Complexity | 782 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 501.226g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 37 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 4 |
| Isotope Atom Count | 0 |
| Molecular Weight | 501.583g/mol |
| Monoisotopic Mass | 501.226g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 117A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H315-H319-H335
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Packing Group
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Precautionary statements
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P261-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number