| CAS Number | 713509-19-4 |
| Catalog Number | AG00FE8S(AGN-PC-0TYVE1) |
| Chemical Name | Acetic acid, 2-(4-propoxyphenoxy)- |
| IUPAC Name | 2-(4-propoxyphenoxy)acetic acid |
| InChI | InChI=1S/C11H14O4/c1-2-7-14-9-3-5-10(6-4-9)15-8-11(12)13/h3-6H,2,7-8H2,1H3,(H,12,13) |
| InChI Key | ZOZBDXUBFHRCQD-UHFFFAOYSA-N |
| MDL Number | MFCD06823825 |
| Molecular Formula | C11H14O4 |
| Molecular Weight | 210.2265 |
| SMILES | O=C(O)COC1=CC=C(OCCC)C=C1 |
| Synonyms | 2-(4-propoxyphenoxy)acetic Acid,
(4-propoxyphenoxy)acetic acid,
713509-19-4,
Acetic acid, 2-(4-propoxyphenoxy)-,
AC1NHR9W,
AC1Q2YGD,
SCHEMBL5275333,
CTK6E6010,
DTXSID50406553,
ZINC4219013,
AKOS008045654,
MCULE-8693939436,
NE31601,
RT-005544,
EN300-18842,
SR-01000070786,
SR-01000070786-1,
Acetic acid, p-propoxyphenoxy- (5CI),
CID4794463,
|
| Complexity | 185 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.229g/mol |
| Monoisotopic Mass | 210.089g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number