| CAS Number | 142810-19-3 |
| Catalog Number | AG007KMR(AGN-PC-0O2IHQ) |
| Chemical Name | Glycine, N-[N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-valyl]- |
| IUPAC Name | 2-[[(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-methylbutanoyl]amino]acetic acid |
| InChI | InChI=1S/C22H24N2O5/c1-13(2)20(21(27)23-11-19(25)26)24-22(28)29-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18,20H,11-12H2,1-2H3,(H,23,27)(H,24,28)(H,25,26)/t20-/m0/s1 |
| InChI Key | RWMPPRIMKZLKTB-FQEVSTJZSA-N |
| MDL Number | MFCD18427309 |
| Molecular Formula | C22H24N2O5 |
| Molecular Weight | 396.4364 |
| SMILES | O=C(O)CNC([C@H](C(C)C)NC(OCC1C2=C(C3=C1C=CC=C3)C=CC=C2)=O)=O |
| Synonyms | 142810-19-3,
Glycine, N-[N-[(9H-fluoren-9-ylmethoxy)carbonyl]-L-valyl]-,
SCHEMBL18949765,
CTK0B5584,
MFCD18427309,
AKOS030212653,
ZINC141883836,
N-alpha-(9-Fluorenylmethyloxycarbonyl)-L-valinyl-glycine,
Fmoc-Val-Gly-OH,
|
| Complexity | 586 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 396.169g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 396.443g/mol |
| Monoisotopic Mass | 396.169g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 105A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.4 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
|
Hazard Class
|
9
|
|
Hazard statements
|
H410
|
|
Packing Group
|
Ⅲ
|
|
Precautionary statements
|
P273-P501
|
|
UN Code
|
UN 3077
|
Certificate of Analysis
Lot Number