| CAS Number | 220497-92-7 |
| Catalog Number | AG0070S8(AGN-PC-0QYM0I) |
| Chemical Name | Fmoc-D-2-amino-4-bromo-4-pentenoic acid |
| IUPAC Name | (2R)-4-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic acid |
| InChI | InChI=1S/C20H18BrNO4/c1-12(21)10-18(19(23)24)22-20(25)26-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,17-18H,1,10-11H2,(H,22,25)(H,23,24)/t18-/m1/s1 |
| InChI Key | BYQROHMHEGJMPD-GOSISDBHSA-N |
| MDL Number | MFCD01311777 |
| Molecular Formula | C20H18BrNO4 |
| Molecular Weight | 416.2652 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@@H](C(=O)O)CC(=C)Br |
| Synonyms | Fmoc-D-2-Amino-4-bromo-4-pentenoic acid,
220497-92-7,
(R)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-bromopent-4-enoic acid,
SCHEMBL18982750,
CTK8E6709,
ZINC2243706,
MFCD01311777,
AKOS025294930,
FCH4051138,
ACM220497927,
PS-12809,
RT-012920,
(2R)-4-bromanyl-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic acid,
(2R)-4-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic acid,
(2R)-4-bromo-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]-4-pentenoic acid,
4-pentenoic acid, 4-bromo-2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-, (2R)-,
(R)-N-Fmoc-(2-bromoallyl)glycine,
CID7006565,
(2S)-4-bromo-2-(9H-fluoren-9-ylmethoxycarbonylamino)pent-4-enoic Acid,
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| Complexity | 530 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 415.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 26 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 416.271g/mol |
| Monoisotopic Mass | 415.042g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 75.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number