| CAS Number | 433291-96-4 |
| Catalog Number | AG00D8G9(AGN-PC-0RROTG) |
| Chemical Name | 2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(2-fluorophenyl)acetic acid |
| IUPAC Name | 2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(2-fluorophenyl)acetic acid |
| InChI | InChI=1S/C23H18FNO4/c24-20-12-6-5-11-18(20)21(22(26)27)25-23(28)29-13-19-16-9-3-1-7-14(16)15-8-2-4-10-17(15)19/h1-12,19,21H,13H2,(H,25,28)(H,26,27) |
| InChI Key | HFDAWMNMWMAJCX-UHFFFAOYSA-N |
| MDL Number | MFCD02682470 |
| Molecular Formula | C23H18FNO4 |
| Molecular Weight | 391.3917 |
| SMILES | O=C(OCC1C=2C=CC=CC2C=3C=CC=CC31)NC(C(=O)O)C=4C=CC=CC4F |
| Synonyms | fmoc-2-fluoro-dl-phenylglycine,
433291-96-4,
2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-2-(2-fluorophenyl)acetic acid,
CTK8F0033,
3326AE,
AKOS030231058,
TR-061871,
{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}(2-fluorophenyl)acetic acid,
C23H18FNO4,
|
| Complexity | 577 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 391.122g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 391.398g/mol |
| Monoisotopic Mass | 391.122g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.4 |
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Certificate of Analysis
Lot Number