Home Other Building Blocks 3-(1H-pyrazol-4-yl)propan-1-amine dihydrochloride

3-(1H-pyrazol-4-yl)propan-1-amine dihydrochloride

CAS No.:
60951-23-7
Catalog Number:
AG01EI15
Molecular Formula:
C6H13Cl2N3
Molecular Weight:
198.0935
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Product Description
Catalog Number:
AG01EI15
Chemical Name:
3-(1H-pyrazol-4-yl)propan-1-amine dihydrochloride
CAS Number:
60951-23-7
Molecular Formula:
C6H13Cl2N3
Molecular Weight:
198.0935
MDL Number:
MFCD25370998
IUPAC Name:
3-(1H-pyrazol-4-yl)propan-1-amine;dihydrochloride
InChI:
InChI=1S/C6H11N3.2ClH/c7-3-1-2-6-4-8-9-5-6;;/h4-5H,1-3,7H2,(H,8,9);2*1H
InChI Key:
FYRUIXNJKZJVHO-UHFFFAOYSA-N
SMILES:
NCCCc1c[nH]nc1.Cl.Cl
Properties
Complexity:
74.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.049g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
4  
Isotope Atom Count:
0
Molecular Weight:
198.091g/mol
Monoisotopic Mass:
197.049g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
54.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties