| CAS Number | 1862379-72-3 |
| Catalog Number | AG01BUQQ |
| Chemical Name | 2-{1,4-dioxa-7-azaspiro[4.4]nonan-7-yl}ethan-1-amine |
| IUPAC Name | 2-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)ethanamine |
| InChI | InChI=1S/C8H16N2O2/c9-2-4-10-3-1-8(7-10)11-5-6-12-8/h1-7,9H2 |
| InChI Key | JMHVMNXRCQUJCQ-UHFFFAOYSA-N |
| MDL Number | MFCD30345380 |
| Molecular Formula | C8H16N2O2 |
| Molecular Weight | 172.2248 |
| SMILES | NCCN1CC2(OCCO2)CC1 |
| Synonyms | 1862379-72-3,
2-{1,4-dioxa-7-azaspiro[4.4]nonan-7-yl}ethan-1-amine,
ZINC306441640,
|
| Complexity | 157 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 172.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 172.228g/mol |
| Monoisotopic Mass | 172.121g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 47.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number