| CAS Number | 1175698-01-7 |
| Catalog Number | AG01DV12 |
| Chemical Name | 2-(3-chlorophenyl)-1-cyclopropylethan-1-one |
| IUPAC Name | 2-(3-chlorophenyl)-1-cyclopropylethanone |
| InChI | InChI=1S/C11H11ClO/c12-10-3-1-2-8(6-10)7-11(13)9-4-5-9/h1-3,6,9H,4-5,7H2 |
| InChI Key | QTMRXMWRDKJQEX-UHFFFAOYSA-N |
| MDL Number | MFCD11935470 |
| Molecular Formula | C11H11ClO |
| Molecular Weight | 194.6574 |
| SMILES | ClC1=CC(CC(C2CC2)=O)=CC=C1 |
| Synonyms | 2-(3-CHLOROPHENYL)-1-CYCLOPROPYLETHAN-1-ONE,
1175698-01-7,
AKOS010015956,
|
| 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 | 2.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number