Home Other Building Blocks 5-tert-butyl-1-(pyridin-3-ylmethyl)-1H-pyrazol-3-amine dihydrochloride

5-tert-butyl-1-(pyridin-3-ylmethyl)-1H-pyrazol-3-amine dihydrochloride

CAS No.:
1803566-56-4
Catalog Number:
AG01AC8H
Molecular Formula:
C13H20Cl2N4
Molecular Weight:
303.2307
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Product Description
Catalog Number:
AG01AC8H
Chemical Name:
5-tert-butyl-1-(pyridin-3-ylmethyl)-1H-pyrazol-3-amine dihydrochloride
CAS Number:
1803566-56-4
Molecular Formula:
C13H20Cl2N4
Molecular Weight:
303.2307
MDL Number:
MFCD26936001
IUPAC Name:
5-tert-butyl-1-(pyridin-3-ylmethyl)pyrazol-3-amine;dihydrochloride
InChI:
InChI=1S/C13H18N4.2ClH/c1-13(2,3)11-7-12(14)16-17(11)9-10-5-4-6-15-8-10;;/h4-8H,9H2,1-3H3,(H2,14,16);2*1H
InChI Key:
RTSYAILTXIIRRB-UHFFFAOYSA-N
SMILES:
Nc1nn(c(c1)C(C)(C)C)Cc1cccnc1.Cl.Cl
Properties
Complexity:
248  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.107g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
303.231g/mol
Monoisotopic Mass:
302.107g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties