| CAS Number | 1342502-29-7 |
| Catalog Number | AG019S79 |
| Chemical Name | 1-benzyl-1,4-diazaspiro[5.5]undecane |
| IUPAC Name | 1-benzyl-1,4-diazaspiro[5.5]undecane |
| InChI | InChI=1S/C16H24N2/c1-3-7-15(8-4-1)13-18-12-11-17-14-16(18)9-5-2-6-10-16/h1,3-4,7-8,17H,2,5-6,9-14H2 |
| InChI Key | JJZFRZJBNRNVCG-UHFFFAOYSA-N |
| MDL Number | MFCD20427737 |
| Molecular Formula | C16H24N2 |
| Molecular Weight | 244.3752 |
| SMILES | C(C1=CC=CC=C1)N1C2(CCCCC2)CNCC1 |
| Synonyms | 1-benzyl-1,4-diazaspiro[5.5]undecane,
1342502-29-7,
ZINC71790343,
AKOS014176174,
MCULE-5699424953,
NE17553,
EN300-92040,
Z1266933949,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.382g/mol |
| Monoisotopic Mass | 244.194g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number