| CAS Number | 858830-26-9 |
| Catalog Number | AG00IDT0(AGN-PC-0782D6) |
| Chemical Name | Cyclododecanone, 2,12-dichloro- |
| IUPAC Name | 2,12-dichlorocyclododecan-1-one |
| InChI | InChI=1S/C12H20Cl2O/c13-10-8-6-4-2-1-3-5-7-9-11(14)12(10)15/h10-11H,1-9H2 |
| InChI Key | MEHFXKFLCAZPSE-UHFFFAOYSA-N |
| MDL Number | MFCD04117917 |
| Molecular Formula | C12H20Cl2O |
| Molecular Weight | 251.1926 |
| SMILES | ClC1CCCCCCCCCC(Cl)C1=O |
| Synonyms | 2,12-Dichlorocyclododecanone,
ACMC-20aj6u,
CTK7H0920,
MFCD04117917,
TC-164541,
D2911,
858830-26-9,
|
| Complexity | 176 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 250.089g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 251.191g/mol |
| Monoisotopic Mass | 250.089g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 17.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 5.3 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number