Home Other Building Blocks 1-[(1-tert-butyl-1H-pyrazol-4-yl)methyl]piperazine hydrochloride

1-[(1-tert-butyl-1H-pyrazol-4-yl)methyl]piperazine hydrochloride

CAS No.:
1909308-46-8
Catalog Number:
AG01C4P0
Molecular Formula:
C12H23ClN4
Molecular Weight:
258.7908
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Product Description
Catalog Number:
AG01C4P0
Chemical Name:
1-[(1-tert-butyl-1H-pyrazol-4-yl)methyl]piperazine hydrochloride
CAS Number:
1909308-46-8
Molecular Formula:
C12H23ClN4
Molecular Weight:
258.7908
MDL Number:
MFCD29906954
IUPAC Name:
1-[(1-tert-butylpyrazol-4-yl)methyl]piperazine;hydrochloride
InChI:
InChI=1S/C12H22N4.ClH/c1-12(2,3)16-10-11(8-14-16)9-15-6-4-13-5-7-15;/h8,10,13H,4-7,9H2,1-3H3;1H
InChI Key:
PJYGXNJLWDLWBP-UHFFFAOYSA-N
SMILES:
CC(n1ncc(c1)CN1CCNCC1)(C)C.Cl
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.161g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
258.794g/mol
Monoisotopic Mass:
258.161g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
33.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties