| CAS Number | 347867-75-8 |
| Catalog Number | AG003M5U(AGN-PC-03T73M) |
| Chemical Name | 5-(4-Fluorophenoxy)-n-valeric acid |
| IUPAC Name | 5-(4-fluorophenoxy)pentanoic acid |
| InChI | InChI=1S/C11H13FO3/c12-9-4-6-10(7-5-9)15-8-2-1-3-11(13)14/h4-7H,1-3,8H2,(H,13,14) |
| InChI Key | SNUHBWJBUYDESY-UHFFFAOYSA-N |
| MDL Number | MFCD02093469 |
| Molecular Formula | C11H13FO3 |
| Molecular Weight | 212.2175 |
| SMILES | OC(=O)CCCCOc1ccc(F)cc1 |
| Synonyms | 5-(4-Fluorophenoxy)valeric Acid,
347867-75-8,
5-(4-Fluorophenoxy)-N-Valeric Acid,
ACMC-209iac,
SCHEMBL4401690,
CTK8B1509,
DTXSID30626414,
ZINC2576970,
ANW-27970,
MFCD02093469,
AKOS009157711,
ACM347867758,
5-(4-FLUOROPHENOXY)PENTANOIC ACID,
TR-035388,
F0410,
I14-102407,
5- -N-VALERICACID,
6-Methoxycarbonylindole-2-boronic acid pinacol ester,
1256359-21-3,
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| Complexity | 188 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 212.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 212.22g/mol |
| Monoisotopic Mass | 212.085g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number