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| IUPAC Name: | 3,5-bis(trifluoromethyl)benzaldehyde |
| Description: | 3,5-Bis(trifluoromethyl)benzaldehyde (CAS# 401-95-6) is an intermediate used in the preparation of meso-3,5-bis(trifluoromethyl)phenyl-substituted expanded porphyrins and its nitrogen-expanded analogs. |
| Molecular Weight: | 242.12 |
| Molecular Formula: | C9H4F6O |
| Canonical SMILES: | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C=O |
| InChI: | InChI=1S/C9H4F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-4H |
| InChI Key: | LDWLIXZSDPXYDR-UHFFFAOYSA-N |
| Boiling Point: | 37 ℃ (1.3 mmHg) |
| Melting Point: | -2 ℃ |
| Purity: | 98 % |
| Density: | 1.469 g/cm3 |
| Appearance: | Clear colorless to yellow liquid |
| MDL: | MFCD00010206 |
| LogP: | 3.53670 |
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