(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)methanamine hydrochloride - CAS 1431962-74-1
Catalog: |
BB052604 |
Product Name: |
(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)methanamine hydrochloride |
CAS: |
1431962-74-1 |
Synonyms: |
(4-(3,5-Dimethyl-1H-pyrazol-1-yl)phenyl)methanaminehydrochloride |
IUPAC Name: | [4-(3,5-dimethylpyrazol-1-yl)phenyl]methanamine;hydrochloride |
Molecular Weight: | 237.73 |
Molecular Formula: | C12H16ClN3 |
Canonical SMILES: | CC1=CC(=NN1C2=CC=C(C=C2)CN)C.Cl |
InChI: | InChI=1S/C12H15N3.ClH/c1-9-7-10(2)15(14-9)12-5-3-11(8-13)4-6-12;/h3-7H,8,13H2,1-2H3;1H |
InChI Key: | LDSBYGUYJLNZAV-UHFFFAOYSA-N |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 237.1032752 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 237.1032752 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 43.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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