| CAS Number | 929341-05-9 |
| Catalog Number | AG01A0AN |
| Chemical Name | 4-(2,3-dihydro-1H-inden-5-yloxy)butanoic acid |
| IUPAC Name | 4-(2,3-dihydro-1H-inden-5-yloxy)butanoic acid |
| InChI | InChI=1S/C13H16O3/c14-13(15)5-2-8-16-12-7-6-10-3-1-4-11(10)9-12/h6-7,9H,1-5,8H2,(H,14,15) |
| InChI Key | MQCWTCZQSLOSNO-UHFFFAOYSA-N |
| MDL Number | MFCD08696413 |
| Molecular Formula | C13H16O3 |
| Molecular Weight | 220.2643 |
| SMILES | OC(CCCOC1=CC2=C(CCC2)C=C1)=O |
| Synonyms | 4-(2,3-DIHYDRO-1H-INDEN-5-YLOXY)BUTANOIC ACID,
929341-05-9,
CTK7J3916,
ZINC11798427,
AKOS000314075,
MCULE-2738713096,
NE44974,
Z1436472881,
|
| Complexity | 239 |
| 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 | 5 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number