| CAS Number | 1172268-86-8 |
| Catalog Number | AG019QCZ(AGN-PC-0WOFK5) |
| Chemical Name | tert-butyl N-{9-aminobicyclo[3.3.1]nonan-3-yl}carbamate |
| IUPAC Name | tert-butyl N-(9-amino-3-bicyclo[3.3.1]nonanyl)carbamate |
| InChI | InChI=1S/C14H26N2O2/c1-14(2,3)18-13(17)16-11-7-9-5-4-6-10(8-11)12(9)15/h9-12H,4-8,15H2,1-3H3,(H,16,17) |
| InChI Key | IRRTYOSSILIGST-UHFFFAOYSA-N |
| MDL Number | MFCD13806403 |
| Molecular Formula | C14H26N2O2 |
| Molecular Weight | 254.3684 |
| SMILES | CC(OC(NC1CC2C(N)C(CCC2)C1)=O)(C)C |
| Synonyms | tert-butyl N-{9-aminobicyclo[3.3.1]nonan-3-yl}carbamate,
tert-butyl 9-aminobicyclo[3.3.1]non-3-ylcarbamate,
1172268-86-8,
AC1Q1NBX,
CTK7D5566,
AKOS026740724,
NE38702,
EN300-87468,
|
| Complexity | 297 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.199g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.374g/mol |
| Monoisotopic Mass | 254.199g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number