| CAS Number | 1258641-17-6 |
| Catalog Number | AG019RKS(AGN-PC-0WOAPD) |
| Chemical Name | tert-Butyl n-[(2-aminocyclohexyl)methyl]carbamate |
| IUPAC Name | tert-butyl N-[(2-aminocyclohexyl)methyl]carbamate |
| InChI | InChI=1S/C12H24N2O2/c1-12(2,3)16-11(15)14-8-9-6-4-5-7-10(9)13/h9-10H,4-8,13H2,1-3H3,(H,14,15) |
| InChI Key | CZEJXQXLKFWTPQ-UHFFFAOYSA-N |
| MDL Number | MFCD17977237 |
| Molecular Formula | C12H24N2O2 |
| Molecular Weight | 228.3312 |
| SMILES | CC(OC(NCC1C(N)CCCC1)=O)(C)C |
| Synonyms | tert-butyl N-[(2-aminocyclohexyl)methyl]carbamate,
1258641-17-6,
AC1Q1NEH,
AKOS013037457,
NE16248,
tert-Butyl (2-aminocyclohexyl)methylcarbamate,
EN300-89898,
tert-butyl N-[(2-aminocyclohexyl)methyl]carbamate, Mixture of diastereomers,
|
| Complexity | 236 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.184g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 228.336g/mol |
| Monoisotopic Mass | 228.184g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number