| CAS Number | 1352318-17-2 |
| Catalog Number | AG009WLB |
| Chemical Name | 2-Chloro-4-(4-methoxyphenyl)toluene |
| IUPAC Name | 2-chloro-4-(4-methoxyphenyl)-1-methylbenzene |
| InChI | InChI=1S/C14H13ClO/c1-10-3-4-12(9-14(10)15)11-5-7-13(16-2)8-6-11/h3-9H,1-2H3 |
| InChI Key | TVMCRMXGSKSRJZ-UHFFFAOYSA-N |
| MDL Number | MFCD20529462 |
| Molecular Formula | C14H13ClO |
| Molecular Weight | 232.7054 |
| SMILES | COc1ccc(cc1)c1ccc(c(c1)Cl)C |
| Synonyms | 2-Chloro-4-(4-methoxyphenyl)toluene,
1352318-17-2,
ACMC-209byl,
2-chloro-4-(4-methoxyphenyl)-1-methylbenzene,
C14H13ClO,
CTK8B0291,
DTXSID20718372,
ANW-19771,
MFCD20529462,
ZINC74937802,
TC-108516,
Z9859,
3-Chloro-4'-methoxy-4-methyl-1,1'-biphenyl,
B-8471,
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| Complexity | 211 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 232.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.707g/mol |
| Monoisotopic Mass | 232.065g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 9.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.5 |
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Certificate of Analysis
Lot Number