| CAS Number | 18113-21-8 |
| Catalog Number | AG0022P7(AGN-PC-00M3WL) |
| Chemical Name | 2-Chloro-3,5-dimethoxyphenol |
| IUPAC Name | 2-chloro-3,5-dimethoxyphenol |
| InChI | InChI=1S/C8H9ClO3/c1-11-5-3-6(10)8(9)7(4-5)12-2/h3-4,10H,1-2H3 |
| InChI Key | UXZNREKNBHZYIT-UHFFFAOYSA-N |
| MDL Number | MFCD02114288 |
| Molecular Formula | C8H9ClO3 |
| Molecular Weight | 188.6083 |
| SMILES | OC1=CC(OC)=CC(OC)=C1Cl |
| Synonyms | 2-Chloro-3,5-dimethoxyphenol,
18113-21-8,
Phenol, 2-chloro-3,5-dimethoxy-,
SCHEMBL10885926,
CTK0A6480,
DTXSID30537273,
ZINC5915308,
MFCD02114288,
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| Complexity | 142 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.024g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.607g/mol |
| Monoisotopic Mass | 188.024g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
Lot Number