| CAS Number | 25329-22-0 |
| Catalog Number | AG00BESN(AGN-PC-0WB51S) |
| Chemical Name | N-(2-Tert-butylcyclohexyl)-2-chloroacetamide |
| IUPAC Name | N-(2-tert-butylcyclohexyl)-2-chloroacetamide |
| InChI | InChI=1S/C12H22ClNO/c1-12(2,3)9-6-4-5-7-10(9)14-11(15)8-13/h9-10H,4-8H2,1-3H3,(H,14,15) |
| InChI Key | IWYOLTOAYPMSIZ-UHFFFAOYSA-N |
| MDL Number | MFCD08591502 |
| Molecular Formula | C12H22ClNO |
| Molecular Weight | 231.7622 |
| SMILES | N(C(CCl)=O)C1CCCCC1C(C)(C)C |
| Synonyms | 25329-22-0,
N-(2-TERT-BUTYLCYCLOHEXYL)-2-CHLOROACETAMIDE,
CHEMBRDG-BB 9070589,
N-(2-(tert-Butyl)cyclohexyl)-2-chloroacetamide,
CTK4F5486,
DTXSID20589322,
MFCD08591502,
AKOS009156163,
Y-3987,
CHEMBRDG-BB9070589,
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| Complexity | 222 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.139g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 231.764g/mol |
| Monoisotopic Mass | 231.139g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number