| CAS Number | 1243374-18-6 |
| Catalog Number | AG00HHN3(AGN-PC-0WR8JV) |
| Chemical Name | 2-Chloro-5-(propan-2-yloxy)phenol |
| IUPAC Name | 2-chloro-5-propan-2-yloxyphenol |
| InChI | InChI=1S/C9H11ClO2/c1-6(2)12-7-3-4-8(10)9(11)5-7/h3-6,11H,1-2H3 |
| InChI Key | GCNXSWJKGRGPII-UHFFFAOYSA-N |
| MDL Number | MFCD16997404 |
| Molecular Formula | C9H11ClO2 |
| Molecular Weight | 186.6354 |
| SMILES | CC(Oc1ccc(c(c1)O)Cl)C |
| Synonyms | 2-CHLORO-5-ISOPROPOXYPHENOL,
1243374-18-6,
2-CHLORO-5-(PROPAN-2-YLOXY)PHENOL,
ZINC95710788,
MB23153,
J3.569.355F,
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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 | 3.2 |
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Certificate of Analysis
Lot Number