3-(3-Methoxyphenoxy)-1-methyl-1H-pyrazol-4-amine hydrochloride - CAS 1431962-80-9
Catalog: |
BB052269 |
Product Name: |
3-(3-Methoxyphenoxy)-1-methyl-1H-pyrazol-4-amine hydrochloride |
CAS: |
1431962-80-9 |
Synonyms: |
3-(3-Methoxyphenoxy)-1-methyl-1H-pyrazol-4-aminehydrochloride |
IUPAC Name: | 3-(3-methoxyphenoxy)-1-methylpyrazol-4-amine;hydrochloride |
Molecular Weight: | 255.70 |
Molecular Formula: | C11H14ClN3O2 |
Canonical SMILES: | CN1C=C(C(=N1)OC2=CC=CC(=C2)OC)N.Cl |
InChI: | InChI=1S/C11H13N3O2.ClH/c1-14-7-10(12)11(13-14)16-9-5-3-4-8(6-9)15-2;/h3-7H,12H2,1-2H3;1H |
InChI Key: | PWARFFCJTRVHQP-UHFFFAOYSA-N |
Complexity: | 227 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.0774544 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.0774544 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 62.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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Halides
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