| CAS Number | 1159822-19-1 |
| Catalog Number | AG00HD5W(AGN-PC-0WNML0) |
| Chemical Name | 1-(2-Aminoethyl)-n-boc-cyclohexylamine, HCl |
| IUPAC Name | tert-butyl N-[1-(2-aminoethyl)cyclohexyl]carbamate;hydrochloride |
| InChI | InChI=1S/C13H26N2O2.ClH/c1-12(2,3)17-11(16)15-13(9-10-14)7-5-4-6-8-13;/h4-10,14H2,1-3H3,(H,15,16);1H |
| InChI Key | XNCJHLCODIPGDU-UHFFFAOYSA-N |
| MDL Number | MFCD09878756 |
| Molecular Formula | C13H27ClN2O2 |
| Molecular Weight | 278.8187 |
| SMILES | Cl[H].O(C(C)(C)C)C(NC1(CCN)CCCCC1)=O |
| Synonyms | 1159822-19-1,
1-(2-aminoethyl)-n-boc-cyclohexylamine hcl,
1-(2-Aminoethyl)-n-boc-cyclohexylamine, HCl,
1-(2-Aminoethyl)-N-Boc-cyclohexylamine hydrochloride,
MFCD09878756,
DTXSID10674216,
AKOS025404069,
AS-35935,
DB-017069,
1-(2-aminoethyl)-n-boc-cyclohexylaminehydrochloride,
[1-(2-Amino-ethyl)-cyclohexyl]-carbamic acid tert-butyl ester hydrochloride,
tert-Butyl [1-(2-aminoethyl)cyclohexyl]carbamate--hydrogen chloride (1/1),
XNCJHLCODIPGDU-UHFFFAOYSA-N,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.176g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 278.821g/mol |
| Monoisotopic Mass | 278.176g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number