| CAS Number | 1243454-35-4 |
| Catalog Number | AG00HHNH(AGN-PC-0WR8JS) |
| Chemical Name | 4-Chloro-3-isopropoxyphenol |
| IUPAC Name | 4-chloro-3-propan-2-yloxyphenol |
| InChI | InChI=1S/C9H11ClO2/c1-6(2)12-9-5-7(11)3-4-8(9)10/h3-6,11H,1-2H3 |
| InChI Key | IVQOVFKLNNLHQC-UHFFFAOYSA-N |
| MDL Number | MFCD16997333 |
| Molecular Formula | C9H11ClO2 |
| Molecular Weight | 186.6354 |
| SMILES | CC(Oc1cc(O)ccc1Cl)C |
| Synonyms | 4-CHLORO-3-ISOPROPOXYPHENOL,
1243454-35-4,
ZINC95710675,
MB22972,
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| Complexity | 139 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.045g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.635g/mol |
| Monoisotopic Mass | 186.045g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3 |
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Certificate of Analysis
Lot Number