Home Halogens 1-(2-chlorophenyl)-1-(1H-pyrazol-1-yl)propan-2-amine dihydrochloride

1-(2-chlorophenyl)-1-(1H-pyrazol-1-yl)propan-2-amine dihydrochloride

CAS No.:
1803589-06-1
Catalog Number:
AG01BA7R
Molecular Formula:
C12H16Cl3N3
Molecular Weight:
308.6345
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Product Description
Catalog Number:
AG01BA7R
Chemical Name:
1-(2-chlorophenyl)-1-(1H-pyrazol-1-yl)propan-2-amine dihydrochloride
CAS Number:
1803589-06-1
Molecular Formula:
C12H16Cl3N3
Molecular Weight:
308.6345
MDL Number:
MFCD28397548
IUPAC Name:
1-(2-chlorophenyl)-1-pyrazol-1-ylpropan-2-amine;dihydrochloride
InChI:
InChI=1S/C12H14ClN3.2ClH/c1-9(14)12(16-8-4-7-15-16)10-5-2-3-6-11(10)13;;/h2-9,12H,14H2,1H3;2*1H
InChI Key:
OWMIJLYAEDBSIF-UHFFFAOYSA-N
SMILES:
CC(C(c1ccccc1Cl)n1cccn1)N.Cl.Cl
Properties
Complexity:
224  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
307.041g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
308.631g/mol
Monoisotopic Mass:
307.041g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties