| CAS Number | 887344-31-2 |
| Catalog Number | AG00IFDM |
| Chemical Name | [1-(1,4-dimethyl-1h-imidazol-2-yl)-ethyl]-carbamic acid tert-butyl ester |
| IUPAC Name | tert-butyl N-[1-(1,4-dimethylimidazol-2-yl)ethyl]carbamate |
| InChI | InChI=1S/C12H21N3O2/c1-8-7-15(6)10(13-8)9(2)14-11(16)17-12(3,4)5/h7,9H,1-6H3,(H,14,16) |
| InChI Key | OOFMNVSHHSUBLC-UHFFFAOYSA-N |
| MDL Number | MFCD05863868 |
| Molecular Formula | C12H21N3O2 |
| Molecular Weight | 239.3140 |
| SMILES | CC(NC(=O)OC(C)(C)C)C1=NC(C)=CN1C |
| Synonyms | 887344-31-2,
[1-(1,4-DIMETHYL-1H-IMIDAZOL-2-YL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER,
tert-Butyl (1-(1,4-dimethyl-1H-imidazol-2-yl)ethyl)carbamate,
ZX-AT021532,
AR1124,
MFCD05863868,
OR1042,
FCH1624256,
AS-45032,
X-2848,
1-(1,4-Dimethyl-1H-imidazol-2yl)ethanamine, N-BOC protected,
tert-butyl N-[1-(1,4-dimethylimidazol-2-yl)ethyl]carbamate,
|
| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 239.163g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 239.319g/mol |
| Monoisotopic Mass | 239.163g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 56.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.4 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number