| CAS Number | 16450-38-7 |
| Catalog Number | AG00IMCL(AGN-PC-009IN4) |
| Chemical Name | 5-Azoniaspiro[4.4]nonane, bromide |
| IUPAC Name | 5-azoniaspiro[4.4]nonane;bromide |
| InChI | InChI=1S/C8H16N.BrH/c1-2-6-9(5-1)7-3-4-8-9;/h1-8H2;1H/q+1;/p-1 |
| InChI Key | PQTWYBSYKLXZME-UHFFFAOYSA-M |
| MDL Number | MFCD30749246 |
| Molecular Formula | C8H16BrN |
| Molecular Weight | 206.1233 |
| NSC Number | 28372 |
| SMILES | C1CCC[N+]12CCCC2.[Br-] |
| Synonyms | 5-azoniaspiro[4.4]nonane Bromide,
16450-38-7,
SCHEMBL17022300,
DTXSID80466504,
1,1'-spirobipyrrolidinium bromide,
PQTWYBSYKLXZME-UHFFFAOYSA-M,
NSC28372,
NSC-28372,
5-azoniaspiro-[4.4]-nonane bromide,
5-Azaspiro[4.4]nonan-5-ium bromide,
5-azoniaspiro[4.4]nonane,bromide,
CID11458396,
A3091,
|
| Complexity | 79.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 205.047g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 206.127g/mol |
| Monoisotopic Mass | 205.047g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 0A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number