| CAS Number | 178119-93-2 |
| Catalog Number | AG0025RM(AGN-PC-0QB8VF) |
| Chemical Name | Benzeneacetic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-hydroxy-, (αR)- |
| IUPAC Name | (2R)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-2-(4-hydroxyphenyl)acetic acid |
| InChI | InChI=1S/C23H19NO5/c25-15-11-9-14(10-12-15)21(22(26)27)24-23(28)29-13-20-18-7-3-1-5-16(18)17-6-2-4-8-19(17)20/h1-12,20-21,25H,13H2,(H,24,28)(H,26,27)/t21-/m1/s1 |
| InChI Key | QBYSEGZHOGZXFO-OAQYLSRUSA-N |
| MDL Number | MFCD02682475 |
| Molecular Formula | C23H19NO5 |
| Molecular Weight | 389.4007 |
| SMILES | O=C(N[C@H](c1ccc(cc1)O)C(=O)O)OCC1c2ccccc2c2c1cccc2 |
| Synonyms | 178119-93-2,
(R)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-2-(4-hydroxyphenyl)acetic acid,
FMOC-D-4-HYDROXYPHENYLGLYCINE,
SCHEMBL6507736,
CTK8B8534,
DTXSID80673973,
ZINC2583184,
9343AA,
ANW-60627,
AB12245,
AJ-43193,
TR-061877,
(R)-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}(4-hydroxyphenyl)acetic acid,
(2R)-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)(4-hydroxyphenyl)acetic acid,
Benzeneacetic acid, alpha-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-4-hydroxy-, (alphaR)-,
C23H19NO5,
QBYSEGZHOGZXFO-OAQYLSRUSA-N,
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| Complexity | 566 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 389.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 29 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 389.407g/mol |
| Monoisotopic Mass | 389.126g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 95.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H317-H319
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number