| CAS Number | 63525-12-2 |
| Catalog Number | AG00IB8A(AGN-PC-0NIPWW) |
| Chemical Name | 2,4-Dichloro-5-methybenzaldehyde |
| IUPAC Name | 2,4-dichloro-5-methylbenzaldehyde |
| InChI | InChI=1S/C8H6Cl2O/c1-5-2-6(4-11)8(10)3-7(5)9/h2-4H,1H3 |
| InChI Key | FUZMBIPHAGPZEY-UHFFFAOYSA-N |
| MDL Number | MFCD11845977 |
| Molecular Formula | C8H6Cl2O |
| Molecular Weight | 189.0386 |
| SMILES | c1(c(cc(c(c1)C=O)Cl)Cl)C |
| Synonyms | 2,4-Dichloro-5-methylbenzaldehyde,
63525-12-2,
2,4-dichloro-5-methybenzaldehyde,
MFCD11845977,
ZINC36532801,
AKOS006345801,
AS-43340,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.98g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 189.035g/mol |
| Monoisotopic Mass | 187.98g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number