| CAS Number | 1520738-14-0 |
| Catalog Number | AG01C1RL |
| Chemical Name | 2-(2-(cyclopentyloxy)phenyl)acetic acid |
| IUPAC Name | 2-(2-cyclopentyloxyphenyl)acetic acid |
| InChI | InChI=1S/C13H16O3/c14-13(15)9-10-5-1-4-8-12(10)16-11-6-2-3-7-11/h1,4-5,8,11H,2-3,6-7,9H2,(H,14,15) |
| InChI Key | URWGNKNYSDYOLP-UHFFFAOYSA-N |
| MDL Number | MFCD23978931 |
| Molecular Formula | C13H16O3 |
| Molecular Weight | 220.2643 |
| SMILES | OC(CC1=C(OC2CCCC2)C=CC=C1)=O |
| Synonyms | 2-[2-(cyclopentyloxy)phenyl]acetic acid,
1520738-14-0,
ZINC87797956,
AKOS019307987,
Z2293607023,
|
| Complexity | 233 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 220.11g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 220.268g/mol |
| Monoisotopic Mass | 220.11g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
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Certificate of Analysis
Lot Number