| CAS Number | 1416438-72-6 |
| Catalog Number | AG001GSH(AGN-PC-0WD6VM) |
| Chemical Name | 2-BENZYL-2-AZASPIRO[3.3]HEPTANE |
| IUPAC Name | 2-benzyl-2-azaspiro[3.3]heptane |
| InChI | InChI=1S/C13H17N/c1-2-5-12(6-3-1)9-14-10-13(11-14)7-4-8-13/h1-3,5-6H,4,7-11H2 |
| InChI Key | WCIHJDHZGRPNOX-UHFFFAOYSA-N |
| MDL Number | MFCD22690547 |
| Molecular Formula | C13H17N |
| Molecular Weight | 187.2808 |
| SMILES | N1(CC2=CC=CC=C2)CC3(CCC3)C1 |
| Synonyms | 2-benzyl-2-azaspiro[3.3]heptane,
1416438-72-6,
2-BENZYL-2-AZASPIRO[3.3]HEPTANES,
MFCD22690547,
ZINC91692865,
AKOS025286158,
FCH2309370,
2-benzyl-2-azaspiro[3.3]heptane,97%,
2-benzyl-2-azaspiro[3.3]heptanes,97%,
AK165596,
AS-41342,
SC-68883,
AB0050284,
2-Azaspiro[3.3]heptane, 2-(phenylmethyl)-,
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| Complexity | 193 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.136g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.286g/mol |
| Monoisotopic Mass | 187.136g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 3.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number