| CAS Number | 82129-45-1 |
| Catalog Number | AG01BTEU(AGN-PC-0L0H0E) |
| Chemical Name | 2-Ethoxy-6-fluorobenzaldehyde |
| IUPAC Name | 2-ethoxy-6-fluorobenzaldehyde |
| InChI | InChI=1S/C9H9FO2/c1-2-12-9-5-3-4-8(10)7(9)6-11/h3-6H,2H2,1H3 |
| InChI Key | VHZCPJWEAMDEKL-UHFFFAOYSA-N |
| MDL Number | MFCD02114885 |
| Molecular Formula | C9H9FO2 |
| Molecular Weight | 168.1650 |
| SMILES | CCOC1=C(C=O)C(F)=CC=C1 |
| Synonyms | 2-ethoxy-6-fluorobenzaldehyde,
82129-45-1,
AC1MXHZT,
SCHEMBL4542715,
VHZCPJWEAMDEKL-UHFFFAOYSA-N,
ZINC5953789,
AKOS022637545,
2-ethoxy-6-fluoro-benzaldehyde,
CID3815894,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.059g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.167g/mol |
| Monoisotopic Mass | 168.059g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number