| CAS Number | 1033693-05-8 |
| Catalog Number | AG00HA1V(AGN-PC-0WB3XZ) |
| Chemical Name | 1-(1-methyl-1H-imidazol-2-yl)-1-butanamine |
| IUPAC Name | 1-(1-methylimidazol-2-yl)butan-1-amine |
| InChI | InChI=1S/C8H15N3/c1-3-4-7(9)8-10-5-6-11(8)2/h5-7H,3-4,9H2,1-2H3 |
| InChI Key | FBTHRJBKKWLZTR-UHFFFAOYSA-N |
| MDL Number | MFCD10686561 |
| Molecular Formula | C8H15N3 |
| Molecular Weight | 153.2248 |
| SMILES | C1(C(CCC)N)=NC=CN1C |
| Synonyms | 1033693-05-8,
1-(1-Methyl-1H-imidazol-2-yl)butan-1-amine,
1-(1-METHYL-1H-IMIDAZOL-2-YL)-1-BUTANAMINE,
1-(1-methylimidazol-2-yl)butan-1-amine,
ALBB-011811,
MFCD10686561,
AKOS005173471,
MCULE-5113053511,
[1-(1-methyl-1H-imidazol-2-yl)butyl]amine,
Y-6341,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 153.127g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 153.229g/mol |
| Monoisotopic Mass | 153.127g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 43.8A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
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Certificate of Analysis
Lot Number