| CAS Number | 861114-47-8 |
| Catalog Number | AG00IDWV(AGN-PC-0WNGDN) |
| Chemical Name | Allyl 2-((2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)ethyl)amino)acetate hydrochloride |
| IUPAC Name | prop-2-enyl 2-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethylamino]acetate;hydrochloride |
| InChI | InChI=1S/C22H24N2O4.ClH/c1-2-13-27-21(25)14-23-11-12-24-22(26)28-15-20-18-9-5-3-7-16(18)17-8-4-6-10-19(17)20;/h2-10,20,23H,1,11-15H2,(H,24,26);1H |
| InChI Key | XFOMYRTWUSNKBU-UHFFFAOYSA-N |
| MDL Number | MFCD28404628 |
| Molecular Formula | C22H25ClN2O4 |
| Molecular Weight | 416.8979 |
| SMILES | Cl.C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)NCCNCC(=O)OCC=C |
| Synonyms | 861114-47-8,
Allyl 2-((2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)ethyl)amino)acetate hydrochloride,
Fmoc Aeg-O-Ally HCl,
KS-00000LAK,
MFCD28404628,
AKOS027328214,
AK327935,
DS-12049,
|
| Complexity | 517 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 416.15g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 416.902g/mol |
| Monoisotopic Mass | 416.15g/mol |
| Rotatable Bond Count | 11 |
| Topological Polar Surface Area | 76.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number