| CAS Number | 429672-02-6 |
| Catalog Number | AG00CQTF(AGN-PC-03MP9Y) |
| Chemical Name | 1-Boc-3-azidoazetidine |
| IUPAC Name | tert-butyl 3-azidoazetidine-1-carboxylate |
| InChI | InChI=1S/C8H14N4O2/c1-8(2,3)14-7(13)12-4-6(5-12)10-11-9/h6H,4-5H2,1-3H3 |
| InChI Key | ZHQJKBCCOFSQEM-UHFFFAOYSA-N |
| MDL Number | MFCD19686277 |
| Molecular Formula | C8H14N4O2 |
| Molecular Weight | 198.2224 |
| SMILES | [N-]=[N+]=NC1CN(C1)C(=O)OC(C)(C)C |
| Synonyms | tert-butyl 3-azidoazetidine-1-carboxylate,
1-Boc-3-azido-azetidine,
429672-02-6,
SCHEMBL13621520,
ZHQJKBCCOFSQEM-UHFFFAOYSA-N,
ZINC68576218,
3-azido-1-(t-butoxycarbonyl)azetidine,
AKOS026706192,
3-azido-1-(t-butoxycarbonyl)-azetidine,
EN300-81032,
3-Azido-azetidine-1-carboxylic Acid tert-butyl Ester,
F1907-0047,
1-Azetidinecarboxylic acid, 3-azido-, 1,1-dimethylethyl ester,
|
| Complexity | 272 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 198.112g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 198.226g/mol |
| Monoisotopic Mass | 198.112g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.9A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number