| CAS Number | 19361-59-2 |
| Catalog Number | AG00I301(AGN-PC-0NJJGS) |
| Chemical Name | Benzaldehyde, 2,3,4-trichloro- |
| IUPAC Name | 2,3,4-trichlorobenzaldehyde |
| InChI | InChI=1S/C7H3Cl3O/c8-5-2-1-4(3-11)6(9)7(5)10/h1-3H |
| InChI Key | WMOOOIUXYRHDEZ-UHFFFAOYSA-N |
| MDL Number | MFCD00204047 |
| Molecular Formula | C7H3Cl3O |
| Molecular Weight | 209.4571 |
| SMILES | ClC1=C(C=O)C=CC(=C1Cl)Cl |
| Synonyms | 2,3,4-trichlorobenzaldehyde,
19361-59-2,
Benzaldehyde, 2,3,4-trichloro-,
Trichlorbenzaldehyd,
4,5,6-trichlorobenzaldehyde,
2,3,4-trichloro-benzaldehyde,
SCHEMBL1312057,
WMOOOIUXYRHDEZ-UHFFFAOYSA-N,
ZINC39251472,
AM20030259,
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| Complexity | 151 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 207.925g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 209.45g/mol |
| Monoisotopic Mass | 207.925g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
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