| CAS Number | 738625-30-4 |
| Catalog Number | AG00ICGD(AGN-PC-01A9TB) |
| Chemical Name | 4-Fmoc-1-carboxymethyl-piperazin-2-one |
| IUPAC Name | 2-[4-(9H-fluoren-9-ylmethoxycarbonyl)-2-oxopiperazin-1-yl]acetic acid |
| InChI | InChI=1S/C21H20N2O5/c24-19-11-23(10-9-22(19)12-20(25)26)21(27)28-13-18-16-7-3-1-5-14(16)15-6-2-4-8-17(15)18/h1-8,18H,9-13H2,(H,25,26) |
| InChI Key | UINCHYCYSIPMAL-UHFFFAOYSA-N |
| MDL Number | MFCD05663772 |
| Molecular Formula | C21H20N2O5 |
| Molecular Weight | 380.3939 |
| SMILES | OC(CN1C(=O)CN(C(OCC2C3=C(C=CC=C3)C3=C2C=CC=C3)=O)CC1)=O |
| Synonyms | 4-Fmoc-1-carboxymethyl-piperazin-2-one,
738625-30-4,
4-Fmoc-1-caboxymethyl-piperazin-2-one,
ZINC2547870,
5616AH,
MFCD05663772,
A-8398,
4-Fmoc-1-carboxymethyl-piperazin-2-one, AldrichCPR,
1-Piperazineacetic acid, 4-[(9H-fluoren-9-ylmethoxy)carbonyl]-2-oxo-,
C21H20N2O5,
|
| Complexity | 602 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 380.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 380.4g/mol |
| Monoisotopic Mass | 380.137g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 87.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number