| CAS Number | 1260640-43-4 |
| Catalog Number | AG00HITF(AGN-PC-0WQX16) |
| Chemical Name | (R,S)-Fmoc-2-amino-4,4-difluoro-butyric acid |
| IUPAC Name | 2-(9H-fluoren-9-ylmethoxycarbonylamino)-4,4-difluorobutanoic acid |
| InChI | InChI=1S/C19H17F2NO4/c20-17(21)9-16(18(23)24)22-19(25)26-10-15-13-7-3-1-5-11(13)12-6-2-4-8-14(12)15/h1-8,15-17H,9-10H2,(H,22,25)(H,23,24) |
| InChI Key | AYIZPDXXYIFMQC-UHFFFAOYSA-N |
| MDL Number | MFCD06738956 |
| Molecular Formula | C19H17F2NO4 |
| Molecular Weight | 361.3394 |
| SMILES | OC(C(NC(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)CC(F)F)=O |
| Synonyms | (R,S)-FMOC-2-AMINO-4,4-DIFLUORO-BUTYRIC ACID,
1260640-43-4,
(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4,4-difluorobutanoic acid,
2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4,4-difluorobutanoic acid,
CTK8I8007,
MFCD06738956,
AKOS026739954,
AB28259,
A-8952,
F8887-2890,
Z1805585481,
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4,4-difluorobutanoic acid,
2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-4,4-DIFLUORO-BUTYRIC ACID,
467442-21-3,
|
| Complexity | 494 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 361.113g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 361.345g/mol |
| Monoisotopic Mass | 361.113g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number