| CAS Number | 1306075-87-5 |
| Catalog Number | AG01BDRW |
| Chemical Name | 2-(cyclohexyloxy)-4-methoxybenzoic acid |
| IUPAC Name | 2-cyclohexyloxy-4-methoxybenzoic acid |
| InChI | InChI=1S/C14H18O4/c1-17-11-7-8-12(14(15)16)13(9-11)18-10-5-3-2-4-6-10/h7-10H,2-6H2,1H3,(H,15,16) |
| InChI Key | SOLZTTOFXHFKGA-UHFFFAOYSA-N |
| MDL Number | MFCD13475648 |
| Molecular Formula | C14H18O4 |
| Molecular Weight | 250.2903 |
| SMILES | COC1=CC(OC2CCCCC2)=C(C(O)=O)C=C1 |
| Synonyms | 2-(cyclohexyloxy)-4-methoxybenzoic acid,
1306075-87-5,
ZINC42372636,
AKOS010520700,
MCULE-7285251968,
NE50440,
Z1863617779,
|
| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.294g/mol |
| Monoisotopic Mass | 250.121g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number