| CAS Number | 540483-58-7 |
| Catalog Number | AG01AJNE(AGN-PC-0OC01B) |
| Chemical Name | N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-(2-phenylethyl)glycine |
| IUPAC Name | 2-[9H-fluoren-9-ylmethoxycarbonyl(2-phenylethyl)amino]acetic acid |
| InChI | InChI=1S/C25H23NO4/c27-24(28)16-26(15-14-18-8-2-1-3-9-18)25(29)30-17-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,23H,14-17H2,(H,27,28) |
| InChI Key | LFQGEVARORMAGZ-UHFFFAOYSA-N |
| MDL Number | MFCD30187632 |
| Molecular Formula | C25H23NO4 |
| Molecular Weight | 401.4544 |
| SMILES | O=C(O)CN(C(OCC3C2=C(C4=C3C=CC=C4)C=CC=C2)=O)CCC1=CC=CC=C1 |
| Synonyms | 540483-58-7,
N-Fmoc-N-(2-phenylethyl)-glycine,
Fmoc-N-Phenethyl-Gly-OH,
MFCD30187632,
AKOS033937645,
ZINC222449880,
Z2527705496,
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}(2-phenylethyl)amino)acetic acid,
2-{[(9H-fluoren-9-ylmethoxy)carbonyl](2-phenylethyl)amino}acetic acid,
|
| Complexity | 566 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 401.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 30 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 401.462g/mol |
| Monoisotopic Mass | 401.163g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 66.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.8 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard Class
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\N
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Hazard statements
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H315-H319-H335
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Packing Group
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\N
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Precautionary statements
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P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P337+P313-P362-P403+P233-P405-P501
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UN Code
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\N
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Certificate of Analysis
Lot Number