1-[(4-Methylpyrazol-1-yl)methyl]pyrazol-4-amine dihydrochloride - CAS 1431963-62-0
Catalog: |
BB052560 |
Product Name: |
1-[(4-Methylpyrazol-1-yl)methyl]pyrazol-4-amine dihydrochloride |
CAS: |
1431963-62-0 |
Synonyms: |
1-[(4-Methyl-1H-pyrazol-1-yl)methyl]-1H-pyrazol-4-aminedihydrochloride |
IUPAC Name: | 1-[(4-methylpyrazol-1-yl)methyl]pyrazol-4-amine;dihydrochloride |
Molecular Weight: | 250.13 |
Molecular Formula: | C8H13Cl2N5 |
Canonical SMILES: | CC1=CN(N=C1)CN2C=C(C=N2)N.Cl.Cl |
InChI: | InChI=1S/C8H11N5.2ClH/c1-7-2-10-12(4-7)6-13-5-8(9)3-11-13;;/h2-5H,6,9H2,1H3;2*1H |
InChI Key: | JDWVVSKRTOCOES-UHFFFAOYSA-N |
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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