| CAS Number | 376588-52-2 |
| Catalog Number | AG01AJMC(AGN-PC-0O9HGX) |
| Chemical Name | N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-3-methoxyphenylalanine |
| IUPAC Name | 2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-methoxyphenyl)propanoic acid |
| InChI | InChI=1S/C25H23NO5/c1-30-17-8-6-7-16(13-17)14-23(24(27)28)26-25(29)31-15-22-20-11-4-2-9-18(20)19-10-3-5-12-21(19)22/h2-13,22-23H,14-15H2,1H3,(H,26,29)(H,27,28) |
| InChI Key | IKKQVAWYVGALAQ-UHFFFAOYSA-N |
| MDL Number | MFCD17214478 |
| Molecular Formula | C25H23NO5 |
| Molecular Weight | 417.4538 |
| SMILES | C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@@H](CC1=CC(=CC=C1)OC)C(=O)O |
| Synonyms | Fmoc-3-methoxy-DL-phenylalanine,
376588-52-2,
(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(3-methoxyphenyl)propanoic acid,
(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(3-methoxyphenyl)propanoic acid,
AC1NFQZV,
SCHEMBL3230219,
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(3-methoxyphenyl)propanoic Acid,
AKOS026739963,
AK139917,
Fmoc-3-Methoxy-DL-phenylalanine, AldrichCPR,
2-{[(9H-FLUOREN-9-YLMETHOXY)CARBONYL]AMINO}-3-(3-METHOXYPHENYL)PROPANOIC ACID,
CID4712578,
206060-40-4,
917099-04-8,
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| Complexity | 603 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 417.158g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 417.461g/mol |
| Monoisotopic Mass | 417.158g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 84.9A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.6 |
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Certificate of Analysis
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