| CAS Number | 159505-85-8 |
| Catalog Number | AG00ACGP(AGN-PC-0Q7PB8) |
| Chemical Name | Fmoc-D-Phe-OPfp |
| IUPAC Name | (2,3,4,5,6-pentafluorophenyl) (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-phenylpropanoate |
| InChI | InChI=1S/C30H20F5NO4/c31-23-24(32)26(34)28(27(35)25(23)33)40-29(37)22(14-16-8-2-1-3-9-16)36-30(38)39-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22H,14-15H2,(H,36,38)/t22-/m1/s1 |
| InChI Key | WKHPSOMXNCTXPK-JOCHJYFZSA-N |
| MDL Number | MFCD00153378 |
| Molecular Formula | C30H20F5NO4 |
| Molecular Weight | 553.4761 |
| SMILES | O=C(N[C@@H](C(=O)Oc1c(F)c(F)c(c(c1F)F)F)Cc1ccccc1)OCC1c2ccccc2-c2c1cccc2 |
| Synonyms | Fmoc-D-Phe-OPfp,
159505-85-8,
SCHEMBL5494326,
WKHPSOMXNCTXPK-JOCHJYFZSA-N,
CF-841,
MFCD00153378,
AKOS027253132,
ZINC100235602,
K-4996,
N-FMOC-D-phenylalanine pentafluorophenyl ester,
(R)-perfluorophenyl 2-(((9H-fluoren-9-yl)methoxy)carbonylamino)-3-phenylpropanoate,
D-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-,pentafluorophenyl ester,
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| Complexity | 837 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 553.131g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 40 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 553.485g/mol |
| Monoisotopic Mass | 553.131g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 64.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 7 |
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Certificate of Analysis
Lot Number