| CAS Number | 331763-50-9 |
| Catalog Number | AG00BXSI(AGN-PC-0WBO6K) |
| Chemical Name | (4R,5S)-4-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-5-methylheptanoic acid |
| IUPAC Name | (4R,5S)-4-(9H-fluoren-9-ylmethoxycarbonylamino)-5-methylheptanoic acid |
| InChI | InChI=1S/C23H27NO4/c1-3-15(2)21(12-13-22(25)26)24-23(27)28-14-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,15,20-21H,3,12-14H2,1-2H3,(H,24,27)(H,25,26)/t15-,21+/m0/s1 |
| InChI Key | ITDOZAVXEQIJIE-YCRPNKLZSA-N |
| MDL Number | MFCD02094560 |
| Molecular Formula | C23H27NO4 |
| Molecular Weight | 381.4648 |
| SMILES | CC[C@@H]([C@H](NC(=O)OCC1c2ccccc2-c2c1cccc2)CCC(=O)O)C |
| Synonyms | 331763-50-9,
(4R,5S)-4-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-methylheptanoic acid,
(4R,5S)-Fmoc-4-amino-5-methyl-heptanoic acid,
ZINC2389783,
4308AH,
MFCD02094560,
RT-005564,
A-8375,
C23H27NO4,
4-FMOC- -AMINO-5- METHYLHEPTANOICACID,
4-FMOC-(R)-AMINO-5-(S)METHYL HEPTANOIC ACID,
|
| Complexity | 515 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 2 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 381.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 28 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 381.472g/mol |
| Monoisotopic Mass | 381.194g/mol |
| Rotatable Bond Count | 9 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number