Introduction：Basic information about CAS 1913-93-5|Thymolphthalein Complexone, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
| Common Name | Thymolphthalein Complexone |
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| CAS Number | 1913-93-5 | Molecular Weight | 720.76200 |
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| Density | 1.385g/cm3 | Boiling Point | 886.7ºC at 760mmHg |
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| Molecular Formula | C38H44N2O12 | Melting Point | 191ºC |
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| MSDS | / | Flash Point | / |
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Names
| Name | 2-[[5-[1-[3-[[bis(carboxymethyl)amino]methyl]-4-hydroxy-2-methyl-5-propan-2-ylphenyl]-3-oxo-2-benzofuran-1-yl]-2-hydroxy-6-methyl-3-propan-2-ylphenyl]methyl-(carboxymethyl)amino]acetic acid |
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| Synonym | More Synonyms |
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Chemical & Physical Properties
| Density | 1.385g/cm3 |
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| Boiling Point | 886.7ºC at 760mmHg |
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| Melting Point | 191ºC |
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| Molecular Formula | C38H44N2O12 |
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| Molecular Weight | 720.76200 |
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| Exact Mass | 720.28900 |
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| PSA | 222.44000 |
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| LogP | 4.36610 |
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| Vapour Pressure | 1.03E-33mmHg at 25°C |
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| InChIKey | AGXCADFSYJNMEG-UHFFFAOYSA-N |
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| SMILES | Cc1c(C2(c3cc(C(C)C)c(O)c(CN(CC(=O)O)CC(=O)O)c3C)OC(=O)c3ccccc32)cc(C(C)C)c(O)c1CN(CC(=O)O)CC(=O)O |
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Safety Information
| Hazard Codes | C |
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| Safety Phrases | S24/25 |
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| HS Code | 32041900 |
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Customs
Synonyms
| thymolphthalein complexone |
| MFCD00001619 |
| Thymolphthalexone |
| Thymolphthalein Complexon |
| EINECS 217-627-2 |
| Thymophthalexon |
