| CAS Number | 1803590-98-8 |
| Catalog Number | AG01AM3Z |
| Chemical Name | 1,2,6-Triazaspiro[2.5]Oct-1-Ene Hydrochloride |
| IUPAC Name | 1,2,6-triazaspiro[2.5]oct-1-ene;hydrochloride |
| InChI | InChI=1S/C5H9N3.ClH/c1-3-6-4-2-5(1)7-8-5;/h6H,1-4H2;1H |
| InChI Key | IMXHDCAXAAQTBE-UHFFFAOYSA-N |
| MDL Number | MFCD28968354 |
| Molecular Formula | C5H10ClN3 |
| Molecular Weight | 147.6060 |
| SMILES | N1CCC2(CC1)N=N2.Cl |
| Synonyms | 1,2,6-triazaspiro[2.5]oct-1-ene hydrochloride,
1803590-98-8,
AKOS026748461,
F2197-0236,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 147.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 147.606g/mol |
| Monoisotopic Mass | 147.056g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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Certificate of Analysis
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