| CAS Number | 897445-50-0 |
| Catalog Number | AG00IKWI(AGN-PC-0WD8MC) |
| Chemical Name | tert-Butyl 1-methyl-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate |
| IUPAC Name | tert-butyl 1-methyl-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate |
| InChI | InChI=1S/C10H17NO3/c1-9(2,3)14-8(12)11-5-7-10(4,6-11)13-7/h7H,5-6H2,1-4H3 |
| InChI Key | FOLFDQYCYNSXEU-UHFFFAOYSA-N |
| MDL Number | MFCD28501390 |
| Molecular Formula | C10H17NO3 |
| Molecular Weight | 199.2469 |
| SMILES | CC12CN(CC2O1)C(=O)OC(C)(C)C |
| Synonyms | 3-boc-1-methyl-6-oxa-3-azabicyclo[3.1.0]hexane,
897445-50-0,
SCHEMBL1256031,
FOLFDQYCYNSXEU-UHFFFAOYSA-N,
MFCD28501390,
AKOS030238395,
SB12755,
AS-54087,
CS-0051511,
racemic-tert-butyl 1-methyl-6-oxa-3-azabicyclo[3.1.0]hexane-3-carboxylate,
|
| Complexity | 271 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.121g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 199.25g/mol |
| Monoisotopic Mass | 199.121g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 42.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number