| CAS Number | 1383973-53-2 |
| Catalog Number | AG00A17C(AGN-PC-0WG4PO) |
| Chemical Name | Benzyl (5-aminobicyclo[3.2.1]octan-1-yl)carbamate |
| IUPAC Name | benzyl N-(5-amino-1-bicyclo[3.2.1]octanyl)carbamate |
| InChI | InChI=1S/C16H22N2O2/c17-15-7-4-8-16(12-15,10-9-15)18-14(19)20-11-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12,17H2,(H,18,19) |
| InChI Key | APDHVXPBNJZJQV-UHFFFAOYSA-N |
| MDL Number | MFCD30185167 |
| Molecular Formula | C16H22N2O2 |
| Molecular Weight | 274.3581 |
| SMILES | O=C(NC12CCCC(C2)(CC1)N)OCc1ccccc1 |
| Synonyms | Benzyl (5-aminobicyclo[3.2.1]octan-1-yl)carbamate,
1383973-53-2,
SCHEMBL10151695,
APDHVXPBNJZJQV-UHFFFAOYSA-N,
CS-0039055,
benzyl 5-aminobicyclo[3.2.1]octan-1-ylcarbamate,
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| Complexity | 368 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 274.168g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 274.364g/mol |
| Monoisotopic Mass | 274.168g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 64.4A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
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Certificate of Analysis
Lot Number