| CAS Number | 1147422-10-3 |
| Catalog Number | AG00HCWL(AGN-PC-0WRACB) |
| Chemical Name | 1-(2,7-Diazaspiro[3.5]nonan-7-yl)ethanone |
| IUPAC Name | 1-(2,7-diazaspiro[3.5]nonan-7-yl)ethanone |
| InChI | InChI=1S/C9H16N2O/c1-8(12)11-4-2-9(3-5-11)6-10-7-9/h10H,2-7H2,1H3 |
| InChI Key | RJBGDSXUIAWZNV-UHFFFAOYSA-N |
| MDL Number | MFCD13180687 |
| Molecular Formula | C9H16N2O |
| Molecular Weight | 168.2361 |
| SMILES | CC(N1CCC2(CNC2)CC1)=O |
| Synonyms | 1147422-10-3,
1-(2,7-diazaspiro[3.5]nonan-7-yl)ethanone,
Ethanone, 1-(2,7-diazaspiro[3.5]non-7-yl)-,
SCHEMBL994307,
RJBGDSXUIAWZNV-UHFFFAOYSA-N,
ZINC95938211,
1-(2,7-Diaza-spiro[3.5]non-7-yl)-ethanone,
Ethanone,1-(2,7-diazaspiro[3.5]non-7-yl)-,
1-(2,7-DIAZASPIRO[3.5]NON-7-YL)-ETHANONE,
1-[2,7-DIAZASPIRO[3.5]NONAN-7-YL]ETHAN-1-ONE,
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| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 168.126g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 168.24g/mol |
| Monoisotopic Mass | 168.126g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 32.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number