(3-Tert-butyl-1H-pyrazol-5-yl)methylamine hydrochloride - CAS 1028458-52-7
Catalog: |
BB046070 |
Product Name: |
(3-Tert-butyl-1H-pyrazol-5-yl)methylamine hydrochloride |
CAS: |
1028458-52-7 |
Synonyms: |
(5-(tert-Butyl)-1H-pyrazol-3-yl)methanamine hydrochloride |
IUPAC Name: | (3-tert-butyl-1H-pyrazol-5-yl)methanamine;hydrochloride |
Description: | (3-Tert-butyl-1H-pyrazol-5-yl)methylamine hydrochloride (CAS# 1028458-52-7 ) is a useful research chemical. |
Molecular Weight: | 189.68 |
Molecular Formula: | C8H16ClN3 |
Canonical SMILES: | CC(C)(C)C1=NNC(=C1)CN.Cl |
InChI: | InChI=1S/C8H15N3.ClH/c1-8(2,3)7-4-6(5-9)10-11-7;/h4H,5,9H2,1-3H3,(H,10,11);1H |
InChI Key: | SAWDNUVKAJQSAG-UHFFFAOYSA-N |
Complexity: | 128 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 2 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.1032752 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.1032752 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 54.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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