| CAS Number | 1303993-81-8 |
| Catalog Number | AG01DSUG |
| Chemical Name | (3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)pentanoic acid |
| IUPAC Name | (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoic acid |
| InChI | InChI=1S/C20H21NO4/c1-2-13(11-19(22)23)21-20(24)25-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18H,2,11-12H2,1H3,(H,21,24)(H,22,23)/t13-/m0/s1 |
| InChI Key | RUDHGDWNJABZLC-ZDUSSCGKSA-N |
| MDL Number | MFCD08275908 |
| Molecular Formula | C20H21NO4 |
| Molecular Weight | 339.3850 |
| SMILES | CC[C@H](NC(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)CC(O)=O |
| Synonyms | (S)-3-(9H-Fluoren-9-ylmethoxycarbonylamino)-pentanoic acid,
AC1OGVPV,
(s)-fmoc-b3-aminopentanoic acid,
CTK6B1623,
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)pentanoic Acid,
ZINC4299262,
1303993-81-8,
CID7176372,
|
| Complexity | 458 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 339.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 339.391g/mol |
| Monoisotopic Mass | 339.147g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number