| CAS Number | 1056619-71-6 |
| Catalog Number | AG01DR5N(AGN-PC-01RGQW) |
| Chemical Name | 1-(1-methylethyl)-1H-imidazol-2-amine |
| IUPAC Name | 1-propan-2-ylimidazol-2-amine |
| InChI | InChI=1S/C6H11N3/c1-5(2)9-4-3-8-6(9)7/h3-5H,1-2H3,(H2,7,8) |
| InChI Key | GDLAPQLBKLYDGT-UHFFFAOYSA-N |
| MDL Number | MFCD12403595 |
| Molecular Formula | C6H11N3 |
| Molecular Weight | 125.1716 |
| SMILES | C(C)(C)N1C(=NC=C1)N |
| Synonyms | 1-Isopropyl-1H-imidazol-2-amine,
1056619-71-6,
1-isopropyl-1H-imidazol-2-ylamine,
SCHEMBL2361161,
SCHEMBL13403145,
AKOS006347535,
ZINC100806394,
KS-8646,
1-(propan-2-yl)-1H-imidazol-2-amine,
1-(1-methylethyl)-1H-Imidazol-2-amine,
F8886-3851,
|
| Complexity | 92.3 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 125.095g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 125.175g/mol |
| Monoisotopic Mass | 125.095g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.4 |
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Certificate of Analysis
Lot Number