Introduction:Basic information about CAS 94393-29-0|3-[4-[4-(1-Ethyl-1H-tetrazole-5-ylthiomethyl)-1-(4-nitrophenyl)-3-undecyl-5-py, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | 3-[4-[4-(1-Ethyl-1H-tetrazole-5-ylthiomethyl)-1-(4-nitrophenyl)-3-undecyl-5-pyrazolyloxy]-1-hydroxy-2-naphthoylamino]propionic acid |
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| CAS Number | 94393-29-0 | Molecular Weight | 758.88600 |
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| Density | / | Boiling Point | / |
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| Molecular Formula | C38H46N8O7S | Melting Point | / |
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| MSDS | / | Flash Point | / |
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Names
| Name | 3-[[1-hydroxy-4-[2-(4-nitrophenyl)-4-[1-(2H-tetrazol-5-ylsulfanyl)propyl]-5-undecylpyrazol-3-yl]oxynaphthalene-2-carbonyl]amino]propanoic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Molecular Formula | C38H46N8O7S |
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| Molecular Weight | 758.88600 |
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| Exact Mass | 758.32100 |
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| PSA | 242.75000 |
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| LogP | 9.56390 |
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| InChIKey | GERWHTRMMARAIA-UHFFFAOYSA-N |
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| SMILES | CCCCCCCCCCCc1nn(-c2ccc([N+](=O)[O-])cc2)c(Oc2cc(C(=O)NCCC(=O)O)c(O)c3ccccc23)c1C(CC)Sc1nn[nH]n1 |
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Synonyms
| 3-[4-[4-(1-ethyl-1h-tetrazole-5-ylthiomethyl)-1-(4-nitrophenyl)-3-undecyl-5-pyrazolyloxy]-1-hydroxy-2-naphthoylamino]propanoic acid |