| CAS Number | 339562-33-3 |
| Catalog Number | AG01A7R2 |
| Chemical Name | 4-(9H-Fluoren-3-yl)-4-oxobutanoic acid |
| IUPAC Name | 4-(9H-fluoren-3-yl)-4-oxobutanoic acid |
| InChI | InChI=1S/C17H14O3/c18-16(7-8-17(19)20)13-6-5-12-9-11-3-1-2-4-14(11)15(12)10-13/h1-6,10H,7-9H2,(H,19,20) |
| InChI Key | HGYVIOZQAFDSKF-UHFFFAOYSA-N |
| MDL Number | MFCD09809876 |
| Molecular Formula | C17H14O3 |
| Molecular Weight | 266.2913 |
| SMILES | C1=CC(=CC=2C3=CC=CC=C3CC12)C(CCC(=O)O)=O |
| Synonyms | 4-(9H-FLUOREN-3-YL)-4-OXOBUTANOIC ACID,
339562-33-3,
CTK7J2709,
ZINC19263303,
AKOS000150363,
MCULE-7274042853,
NE22220,
EN300-59577,
|
| Complexity | 390 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.296g/mol |
| Monoisotopic Mass | 266.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 54.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number