| CAS Number | 1445951-65-4 |
| Catalog Number | AG00HX5B(AGN-PC-0WG4GQ) |
| Chemical Name | 11-Benzyl-2,11-Diazaspiro[6.7]Tetradecane |
| IUPAC Name | 11-benzyl-2,11-diazaspiro[6.7]tetradecane |
| InChI | InChI=1S/C19H30N2/c1-2-8-18(9-3-1)16-21-14-6-11-19(12-7-15-21)10-4-5-13-20-17-19/h1-3,8-9,20H,4-7,10-17H2 |
| InChI Key | XARHGETYFWCUFH-UHFFFAOYSA-N |
| MDL Number | MFCD25509340 |
| Molecular Formula | C19H30N2 |
| Molecular Weight | 286.4549 |
| SMILES | C(N1CCCC2(CCCCNC2)CCC1)c1ccccc1 |
| Synonyms | 11-Benzyl-2,11-Diazaspiro[6.7]Tetradecane,
1445951-65-4,
MFCD25509340,
ZINC95698572,
CS-0037516,
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| Complexity | 286 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 286.241g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 21 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 286.463g/mol |
| Monoisotopic Mass | 286.241g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.5 |
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Certificate of Analysis
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