| CAS Number | 1425367-32-3 |
| Catalog Number | AG01DW14 |
| Chemical Name | 1-(3-chlorophenyl)-2-cyclopropylethan-1-one |
| IUPAC Name | 1-(3-chlorophenyl)-2-cyclopropylethanone |
| InChI | InChI=1S/C11H11ClO/c12-10-3-1-2-9(7-10)11(13)6-8-4-5-8/h1-3,7-8H,4-6H2 |
| InChI Key | GRKABJVNDVNOFS-UHFFFAOYSA-N |
| MDL Number | MFCD21107860 |
| Molecular Formula | C11H11ClO |
| Molecular Weight | 194.6574 |
| SMILES | ClC1=CC(C(CC2CC2)=O)=CC=C1 |
| Synonyms | 1-(3-CHLOROPHENYL)-2-CYCLOPROPYLETHAN-1-ONE,
1425367-32-3,
AKOS014235303,
|
| Complexity | 198 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 194.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 194.658g/mol |
| Monoisotopic Mass | 194.05g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number