1-[(1-Methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine dihydrochloride - CAS 1197237-31-2
Catalog: |
BB052561 |
Product Name: |
1-[(1-Methyl-1H-pyrazol-4-yl)methyl]-1H-pyrazol-4-amine dihydrochloride |
CAS: |
1197237-31-2 |
Synonyms: |
1-(1-Methyl-1H-pyrazol-4-ylmethyl)-1H-pyrazol-4-ylamine dihydrochloride |
Related CAS: | 1001757-45-4 (free acid) |
IUPAC Name: | 1-[(1-methylpyrazol-4-yl)methyl]pyrazol-4-amine;dihydrochloride |
Molecular Weight: | 250.13 |
Molecular Formula: | C8H13Cl2N5 |
Canonical SMILES: | CN1C=C(C=N1)CN2C=C(C=N2)N.Cl.Cl |
InChI: | InChI=1S/C8H11N5.2ClH/c1-12-4-7(2-10-12)5-13-6-8(9)3-11-13;;/h2-4,6H,5,9H2,1H3;2*1H |
InChI Key: | BKYDZHYDAPEUMB-UHFFFAOYSA-N |
Appearance: | Solid |
Complexity: | 174 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 249.0548008 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 249.0548008 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 61.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Related Functional Groups
Amines and Anilines
Pyrazoles
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