| CAS Number | 933731-98-7 |
| Catalog Number | AG01EK64 |
| Chemical Name | 2-[2-(thiophen-2-yl)ethoxy]acetic acid |
| IUPAC Name | 2-(2-thiophen-2-ylethoxy)acetic acid |
| InChI | InChI=1S/C8H10O3S/c9-8(10)6-11-4-3-7-2-1-5-12-7/h1-2,5H,3-4,6H2,(H,9,10) |
| InChI Key | NWMNVNKDUBNPKQ-UHFFFAOYSA-N |
| MDL Number | MFCD14694700 |
| Molecular Formula | C8H10O3S |
| Molecular Weight | 186.2282 |
| SMILES | OC(COCCC1SC=CC=1)=O |
| Synonyms | AKOS010582825,
2-[2-(THIOPHEN-2-YL)ETHOXY]ACETIC ACID,
933731-98-7,
|
| Complexity | 149 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 186.035g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 186.225g/mol |
| Monoisotopic Mass | 186.035g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 74.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
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