| CAS Number | 1217631-22-5 |
| Catalog Number | AG009B0O(AGN-PC-0WBO45) |
| Chemical Name | N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-3-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-D-alanine |
| IUPAC Name | (2R)-2,3-bis(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid |
| InChI | InChI=1S/C33H28N2O6/c36-31(37)30(35-33(39)41-19-29-26-15-7-3-11-22(26)23-12-4-8-16-27(23)29)17-34-32(38)40-18-28-24-13-5-1-9-20(24)21-10-2-6-14-25(21)28/h1-16,28-30H,17-19H2,(H,34,38)(H,35,39)(H,36,37)/t30-/m1/s1 |
| InChI Key | CEEGOSWFFHSPHM-SSEXGKCCSA-N |
| MDL Number | MFCD01632030 |
| Molecular Formula | C33H28N2O6 |
| Molecular Weight | 548.5852 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@H](CNC(=O)OCC1C2=CC=CC=C2C=2C=CC=CC12)C(=O)O |
| Synonyms | Fmoc-d-dap(fmoc)-oh,
di-fmoc-d-alpha,beta-diaminopropionic acid,
1217631-22-5,
C33H28N2O6,
SCHEMBL119637,
(R)-2,3-Bis((((9H-fluoren-9-yl)methoxy)carbonyl)amino)propanoic acid,
CTK8F0203,
ZINC2382533,
1261AD,
MFCD01632030,
AKOS024259139,
Di-Fmoc-L-alpha,beta-diaminopropionic acid,
TR-061853,
(2R)-2,3-bis({[(9H-fluoren-9-ylmethoxy)carbonyl]amino})propanoic acid,
N-alpha-N-beta-Bis(9-fluorenylmethyloxycarbonyl)-D-2,3-diaminopropionic acid,
201473-90-7,
|
| Complexity | 899 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 548.195g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 41 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 548.595g/mol |
| Monoisotopic Mass | 548.195g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 114A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number