| CAS Number | 134099-34-6 |
| Catalog Number | AG00HT64(AGN-PC-0WCN25) |
| Chemical Name | 2,6-Difluoro-4-(trifluoromethyl)benzaldehyde |
| IUPAC Name | 2,6-difluoro-4-(trifluoromethyl)benzaldehyde |
| InChI | InChI=1S/C8H3F5O/c9-6-1-4(8(11,12)13)2-7(10)5(6)3-14/h1-3H |
| InChI Key | SEBPODPGYAOCAN-UHFFFAOYSA-N |
| MDL Number | MFCD12404959 |
| Molecular Formula | C8H3F5O |
| Molecular Weight | 210.1008 |
| SMILES | FC1=C(C=O)C(F)=CC(C(F)(F)F)=C1 |
| Synonyms | 2,6-Difluoro-4-(trifluoromethyl)benzaldehyde,
134099-34-6,
SCHEMBL9341736,
MFCD12404959,
ZINC40571362,
FCH1344879,
PC500301,
PS-11412,
X3728,
Benzaldehyde, 2,6-difluoro-4-(trifluoromethyl)-,
C8H3F5O,
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| Complexity | 202 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.01g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.103g/mol |
| Monoisotopic Mass | 210.01g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number