| CAS Number | 2007916-11-0 |
| Catalog Number | AG01EFNK |
| Chemical Name | 6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl tert-butylcarbamate |
| IUPAC Name | 6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl N-tert-butylcarbamate |
| InChI | InChI=1S/C11H17N3O2/c1-11(2,3)13-10(15)16-8-4-6-14-7-5-12-9(8)14/h5,7-8H,4,6H2,1-3H3,(H,13,15) |
| InChI Key | BBDVWGBOCRFMKY-UHFFFAOYSA-N |
| MDL Number | MFCD30472123 |
| Molecular Formula | C11H17N3O2 |
| Molecular Weight | 223.2716 |
| SMILES | CC(C)(C)NC(=O)OC1CCn2ccnc12 |
| Synonyms | 2007916-11-0,
6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl tert-butylcarbamate,
MFCD30472123,
AKOS030628416,
CS-0039366,
6,7-Dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl t-butylcarbamate,
Carbamic acid, N-(1,1-dimethylethyl)-, 6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-7-yl ester,
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| Complexity | 275 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 223.132g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.276g/mol |
| Monoisotopic Mass | 223.132g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 56.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.6 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number