| CAS Number | 1340195-35-8 |
| Catalog Number | AG01B6UG |
| Chemical Name | N-(But-3-yn-1-yl)oxetan-3-amine |
| IUPAC Name | N-but-3-ynyloxetan-3-amine |
| InChI | InChI=1S/C7H11NO/c1-2-3-4-8-7-5-9-6-7/h1,7-8H,3-6H2 |
| InChI Key | NOOGOFXIJNDWRH-UHFFFAOYSA-N |
| MDL Number | MFCD19642233 |
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.1683 |
| SMILES | C#CCCNC1COC1 |
| Synonyms | N-(but-3-yn-1-yl)oxetan-3-amine,
1340195-35-8,
ZINC69769389,
AKOS013403232,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.171g/mol |
| Monoisotopic Mass | 125.084g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 21.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number