| CAS Number | 1159512-58-9 |
| Catalog Number | AG00941B(AGN-PC-0WAIZI) |
| Chemical Name | 2-Fluoro-3-(trifluoromethoxy)benzaldehyde |
| IUPAC Name | 2-fluoro-3-(trifluoromethoxy)benzaldehyde |
| InChI | InChI=1S/C8H4F4O2/c9-7-5(4-13)2-1-3-6(7)14-8(10,11)12/h1-4H |
| InChI Key | IKUSXOFNQSIUDU-UHFFFAOYSA-N |
| MDL Number | MFCD12026472 |
| Molecular Formula | C8H4F4O2 |
| Molecular Weight | 208.1098 |
| SMILES | FC1=C(C=O)C=CC=C1OC(F)(F)F |
| Synonyms | 2-Fluoro-3-(trifluoromethoxy)benzaldehyde,
1159512-58-9,
ACMC-2099re,
SCHEMBL2715747,
CTK7H9944,
DTXSID20672900,
IKUSXOFNQSIUDU-UHFFFAOYSA-N,
KS-00003R6Y,
ANW-16920,
MFCD12026472,
SBB093981,
ZINC36533772,
AKOS026672464,
2-fluoro-3-trifluoromethoxybenzaldehyde,
PS-8043,
CJ-18973,
RT-016645,
Z7742,
B-6494,
C8H4F4O2,
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| Complexity | 204 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.015g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 6 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.112g/mol |
| Monoisotopic Mass | 208.015g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number