| CAS Number | 91143-71-4 |
| Catalog Number | AG00H1D7(AGN-PC-0KH8YS) |
| Chemical Name | 2-(4-acetylphenoxy)propanoic Acid |
| IUPAC Name | 2-(4-acetylphenoxy)propanoic acid |
| InChI | InChI=1S/C11H12O4/c1-7(12)9-3-5-10(6-4-9)15-8(2)11(13)14/h3-6,8H,1-2H3,(H,13,14) |
| InChI Key | LMBHCEXLVUOTAV-UHFFFAOYSA-N |
| MDL Number | MFCD06356477 |
| Molecular Formula | C11H12O4 |
| Molecular Weight | 208.2106 |
| SMILES | CC(C(O)=O)OC1=CC=C(C(C)=O)C=C1 |
| Synonyms | 2-(4-acetylphenoxy)propanoic Acid,
91143-71-4,
AC1Q2BZX,
AC1NPM55,
SCHEMBL943227,
CTK5G8991,
DTXSID30409027,
LMBHCEXLVUOTAV-UHFFFAOYSA-N,
2-(4-acetylphenoxy)propionic acid,
2-(4 -acetylphenoxy)propanoic acid,
AKOS000103091,
AKOS016049718,
MCULE-3745936146,
NE58588,
EN300-09411,
Z56346873,
2- propanoicacid,
CID5160649,
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| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 208.074g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 208.213g/mol |
| Monoisotopic Mass | 208.074g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 63.6A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number