| CAS Number | 210755-31-0 |
| Catalog Number | AG002KXT(AGN-PC-0QXJE2) |
| Chemical Name | D-Histidine, 1-[(1,1-dimethylethoxy)carbonyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, compd. with cyclohexanamine (1:1) (9CI) |
| IUPAC Name | cyclohexanamine;(2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[1-[(2-methylpropan-2-yl)oxycarbonyl]imidazol-4-yl]propanoic acid |
| InChI | InChI=1S/C26H27N3O6.C6H13N/c1-26(2,3)35-25(33)29-13-16(27-15-29)12-22(23(30)31)28-24(32)34-14-21-19-10-6-4-8-17(19)18-9-5-7-11-20(18)21;7-6-4-2-1-3-5-6/h4-11,13,15,21-22H,12,14H2,1-3H3,(H,28,32)(H,30,31);6H,1-5,7H2/t22-;/m1./s1 |
| InChI Key | UDEXYAHZNOKVIG-VZYDHVRKSA-N |
| MDL Number | MFCD00270617 |
| Molecular Formula | C32H40N4O6 |
| Molecular Weight | 576.6832 |
| SMILES | NC1CCCCC1.CC(C)(C)OC(=O)n1cnc(C[C@@H](NC(=O)OCC2c3ccccc3-c3ccccc23)C(O)=O)c1 |
| Synonyms | Fmoc-D-His(Boc)-OH Cha,
210755-31-0,
C26H27N3O6.C6H13N,
6845AH,
MFCD00270617,
fmoc-D-his(boc)-oh cha, AldrichCPR,
D-Histidine, 1-[(1,1-dimethylethoxy)carbonyl]-N-[(9H-fluoren-9-ylmethoxy)carbonyl]-, compd. with cyclohexanamine (1:1) (9CI),
FMOC-D-HIS -OHCHA,
Fmoc-L-His(Boc)-OH DCHA,
210820-99-8,
|
| Complexity | 808 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 576.295g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 42 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 576.694g/mol |
| Monoisotopic Mass | 576.295g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 146A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number