Home Other Building Blocks 2-(1-benzyl-1H-pyrazol-4-yl)ethan-1-amine dihydrochloride

2-(1-benzyl-1H-pyrazol-4-yl)ethan-1-amine dihydrochloride

CAS No.:
1071537-11-5
Catalog Number:
AG019ZIN
Molecular Formula:
C12H17Cl2N3
Molecular Weight:
274.1895
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Product Description
Catalog Number:
AG019ZIN
Chemical Name:
2-(1-benzyl-1H-pyrazol-4-yl)ethan-1-amine dihydrochloride
CAS Number:
1071537-11-5
Molecular Formula:
C12H17Cl2N3
Molecular Weight:
274.1895
MDL Number:
MFCD22369966
IUPAC Name:
2-(1-benzylpyrazol-4-yl)ethanamine;dihydrochloride
InChI:
InChI=1S/C12H15N3.2ClH/c13-7-6-12-8-14-15(10-12)9-11-4-2-1-3-5-11;;/h1-5,8,10H,6-7,9,13H2;2*1H
InChI Key:
GJIGROAPLITWPH-UHFFFAOYSA-N
SMILES:
NCCc1cnn(c1)Cc1ccccc1.Cl.Cl
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.08g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
274.189g/mol
Monoisotopic Mass:
273.08g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties