| CAS Number | 62176-27-6 |
| Catalog Number | AG019U2F(AGN-PC-0L6O5T) |
| Chemical Name | 5-chloro-2-(2-methoxyethoxy)benzoic Acid |
| IUPAC Name | 5-chloro-2-(2-methoxyethoxy)benzoic acid |
| InChI | InChI=1S/C10H11ClO4/c1-14-4-5-15-9-3-2-7(11)6-8(9)10(12)13/h2-3,6H,4-5H2,1H3,(H,12,13) |
| InChI Key | WQDOHODYKAZYCW-UHFFFAOYSA-N |
| MDL Number | MFCD02668674 |
| Molecular Formula | C10H11ClO4 |
| Molecular Weight | 230.6449 |
| SMILES | COCCOC1=C(C(O)=O)C=C(Cl)C=C1 |
| Synonyms | 5-chloro-2-(2-methoxyethoxy)benzoic Acid,
62176-27-6,
AC1N4BA4,
SCHEMBL1505166,
CTK2C5614,
DTXSID60400305,
WQDOHODYKAZYCW-UHFFFAOYSA-N,
ZINC5669833,
AKOS005292511,
MCULE-2074172106,
NE23063,
5-Chloro-2-(2-methoxyethoxy)-benzoic acid,
Benzoic acid, 5-chloro-2-(2-methoxyethoxy)-,
5-CHLORO-2-(2-METHOXY-ETHOXY)-BENZOIC ACID,
Z286108646,
CID4176150,
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| Complexity | 210 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 230.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.644g/mol |
| Monoisotopic Mass | 230.035g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number