| CAS Number | 1394974-97-0 |
| Catalog Number | AG00HVML(AGN-PC-0WR8J4) |
| Chemical Name | 3-Chloro-5-(2-methoxyethoxy)phenol |
| IUPAC Name | 3-chloro-5-(2-methoxyethoxy)phenol |
| InChI | InChI=1S/C9H11ClO3/c1-12-2-3-13-9-5-7(10)4-8(11)6-9/h4-6,11H,2-3H2,1H3 |
| InChI Key | QTMLCFMADWCIJF-UHFFFAOYSA-N |
| MDL Number | MFCD23110982 |
| Molecular Formula | C9H11ClO3 |
| Molecular Weight | 202.6348 |
| SMILES | COCCOc1cc(O)cc(c1)Cl |
| Synonyms | 3-CHLORO-5-(2-METHOXYETHOXY)PHENOL,
1394974-97-0,
ZINC238361086,
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| Complexity | 143 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.04g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.634g/mol |
| Monoisotopic Mass | 202.04g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 38.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
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