| CAS Number | 1009368-28-8 |
| Catalog Number | AG018GZ7(AGN-PC-0WBQ83) |
| Chemical Name | tert-Butyl 3-((chlorocarbonyl)oxy)azetidine-1-carboxylate |
| IUPAC Name | tert-butyl 3-carbonochloridoyloxyazetidine-1-carboxylate |
| InChI | InChI=1S/C9H14ClNO4/c1-9(2,3)15-8(13)11-4-6(5-11)14-7(10)12/h6H,4-5H2,1-3H3 |
| InChI Key | PMFUNKVMRLFUJD-UHFFFAOYSA-N |
| MDL Number | MFCD24387654 |
| Molecular Formula | C9H14ClNO4 |
| Molecular Weight | 235.6648 |
| SMILES | CC(OC(N1CC(OC(Cl)=O)C1)=O)(C)C |
| Synonyms | 1009368-28-8,
tert-butyl 3-[(chlorocarbonyl)oxy]azetidine-1-carboxylate,
tert-Butyl 3-((chlorocarbonyl)oxy)azetidine-1-carboxylate,
SCHEMBL9885679,
PMFUNKVMRLFUJD-UHFFFAOYSA-N,
ZINC90394323,
AKOS026677074,
F2147-1207,
tert-butyl 3-(chlorocarbonyloxy)azetidine-1-carboxylate,
|
| Complexity | 268 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 235.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 235.664g/mol |
| Monoisotopic Mass | 235.061g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 55.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number