| CAS Number | 1051420-16-6 |
| Catalog Number | AG00IMFD(AGN-PC-0WQULJ) |
| Chemical Name | N-Carbobenzoxy-1,12-diaminododecane Hydrochloride |
| IUPAC Name | benzyl N-(12-aminododecyl)carbamate;hydrochloride |
| InChI | InChI=1S/C20H34N2O2.ClH/c21-16-12-7-5-3-1-2-4-6-8-13-17-22-20(23)24-18-19-14-10-9-11-15-19;/h9-11,14-15H,1-8,12-13,16-18,21H2,(H,22,23);1H |
| InChI Key | YISCQBUBEASQMD-UHFFFAOYSA-N |
| MDL Number | MFCD08272292 |
| Molecular Formula | C20H35ClN2O2 |
| Molecular Weight | 370.9571 |
| SMILES | Cl.C(=O)(OCC1=CC=CC=C1)NCCCCCCCCCCCCN |
| Synonyms | n-carbobenzoxy-1,12-diaminododecane hydrochloride,
1051420-16-6,
MFCD08272292,
N-Cbz-1,12-diaminododecane Hydrochloride,
C3472,
Benzyl N-(12-Aminododecyl)carbamate Hydrochloride,
N-(12-Aminododecyl)carbamic Acid Benzyl Ester Hydrochloride,
N-Cbz-1,12-diaminododecane Hydrochloride / Benzyl N-(12-Aminododecyl)carbamate Hydrochloride / N-(12-Aminododecyl)carbamic Acid Benzyl Ester Hydrochloride,
|
| Complexity | 291 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 370.239g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 25 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 370.962g/mol |
| Monoisotopic Mass | 370.239g/mol |
| Rotatable Bond Count | 15 |
| 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