| CAS Number | 70955-01-0 |
| Catalog Number | AG00F9VJ(AGN-PC-0WANP8) |
| Chemical Name | Zeolites, 4A |
| EC Number | 615-217-1 |
| IUPAC Name | (2R,3S)-2-[[(2R)-2-acetamido-3-(3-fluorophenyl)propanoyl]amino]-5-methoxy-4-methoxycarbonyl-3-methyl-5-oxopentanoic acid |
| InChI | InChI=1S/C20H25FN2O8/c1-10(15(19(28)30-3)20(29)31-4)16(18(26)27)23-17(25)14(22-11(2)24)9-12-6-5-7-13(21)8-12/h5-8,10,14-16H,9H2,1-4H3,(H,22,24)(H,23,25)(H,26,27)/t10-,14+,16+/m0/s1 |
| InChI Key | FJUZEZRZKVMAMD-DRZCJDIDSA-N |
| MDL Number | MFCD00131613 |
| Molecular Formula | C20H25FN2O8 |
| SMILES | C[C@H]([C@@H](NC([C@H](NC(C)=O)CC1=CC(F)=CC=C1)=O)C(O)=O)C(C(OC)=O)C(OC)=O |
| Synonyms | 70955-01-0,
Molecular sieves 4A, 4 to 8 mesh,
Molecular sieves 4A, 8 to 12 mesh,
Molecular sieves 4A, 10 to 18 mesh,
Molecular sieves 4A, powder <50 micron,
Molecular sieves 4A, pellets, 3.2mm diameter,
Linde 4A,
MFCD03457537,
Molecular sieve A4 (0.4 nm, 4 A),
Molecular sieves, 4A, 1-2mm beads 250g,
|
| Complexity | 670 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 3 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 440.159g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 31 |
| Hydrogen Bond Acceptor Count | 9 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 440.424g/mol |
| Monoisotopic Mass | 440.159g/mol |
| Rotatable Bond Count | 12 |
| Topological Polar Surface Area | 148A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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-P305+P351+P338
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UN Code
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\N
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Certificate of Analysis
Lot Number