| CAS Number | 1341630-16-7 |
| Catalog Number | AG01AFLD(AGN-PC-0WOAPY) |
| Chemical Name | 1-(1-Methoxypropan-2-yl)-1H-pyrazol-3-amine |
| IUPAC Name | 1-(1-methoxypropan-2-yl)pyrazol-3-amine |
| InChI | InChI=1S/C7H13N3O/c1-6(5-11-2)10-4-3-7(8)9-10/h3-4,6H,5H2,1-2H3,(H2,8,9) |
| InChI Key | LABDBKQLFKITEJ-UHFFFAOYSA-N |
| MDL Number | MFCD19654226 |
| Molecular Formula | C7H13N3O |
| Molecular Weight | 155.1976 |
| SMILES | COCC(N1N=C(N)C=C1)C |
| Synonyms | 1-(1-methoxypropan-2-yl)-1H-pyrazol-3-amine,
1341630-16-7,
AKOS013438260,
NE29962,
|
| Complexity | 120 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 155.106g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 155.201g/mol |
| Monoisotopic Mass | 155.106g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 53.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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