| CAS Number | 709649-70-7 |
| Catalog Number | AG01BFOK(AGN-PC-0CX9KL) |
| Chemical Name | 3-Chloro-2-ethoxybenzaldehyde |
| IUPAC Name | 3-chloro-2-ethoxybenzaldehyde |
| InChI | InChI=1S/C9H9ClO2/c1-2-12-9-7(6-11)4-3-5-8(9)10/h3-6H,2H2,1H3 |
| InChI Key | CRKCZHSKXMXWSB-UHFFFAOYSA-N |
| MDL Number | MFCD24678078 |
| Molecular Formula | C9H9ClO2 |
| Molecular Weight | 184.6196 |
| SMILES | ClC=1C(=C(C=O)C=CC1)OCC |
| Synonyms | 3-chloro-2-ethoxybenzaldehyde,
709649-70-7,
SCHEMBL1253929,
3-Chloro-2-ethoxy-benzaldehyde,
CRKCZHSKXMXWSB-UHFFFAOYSA-N,
Benzaldehyde, 3-chloro-2-ethoxy-,
MFCD24678078,
ZINC98209859,
NE41153,
|
| Complexity | 150 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 184.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 184.619g/mol |
| Monoisotopic Mass | 184.029g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number