| CAS Number | 40792-02-7 |
| Catalog Number | AG01BCX4(AGN-PC-00LI4F) |
| Chemical Name | 2-(chloromethyl)-2-methylcyclopentan-1-one |
| IUPAC Name | 2-(chloromethyl)-2-methylcyclopentan-1-one |
| InChI | InChI=1S/C7H11ClO/c1-7(5-8)4-2-3-6(7)9/h2-5H2,1H3 |
| InChI Key | XWYYBAHMEJIMKQ-UHFFFAOYSA-N |
| MDL Number | MFCD19233585 |
| Molecular Formula | C7H11ClO |
| Molecular Weight | 146.6146 |
| SMILES | CC1(C(=O)CCC1)CCl |
| Synonyms | 2-(chloromethyl)-2-methylcyclopentan-1-one,
40792-02-7,
AKOS006385381,
NE60297,
2-(chloromethyl)-2-methylcyclopentanone,
|
| Complexity | 133 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.614g/mol |
| Monoisotopic Mass | 146.05g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number