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Home Halogens 1-(4-chlorophenyl)-5-(propan-2-yl)-1H-pyrazol-4-amine

1-(4-chlorophenyl)-5-(propan-2-yl)-1H-pyrazol-4-amine

CAS No.:
1508227-54-0
Catalog Number:
AG01BDKA
Molecular Formula:
C12H14ClN3
Molecular Weight:
235.7127
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Product Description
Catalog Number:
AG01BDKA
Chemical Name:
1-(4-chlorophenyl)-5-(propan-2-yl)-1H-pyrazol-4-amine
CAS Number:
1508227-54-0
Molecular Formula:
C12H14ClN3
Molecular Weight:
235.7127
MDL Number:
MFCD21773818
IUPAC Name:
1-(4-chlorophenyl)-5-propan-2-ylpyrazol-4-amine
InChI:
InChI=1S/C12H14ClN3/c1-8(2)12-11(14)7-15-16(12)10-5-3-9(13)4-6-10/h3-8H,14H2,1-2H3
InChI Key:
NSXXGZDMFOQCMU-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)n1ncc(c1C(C)C)N
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.088g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.715g/mol
Monoisotopic Mass:
235.088g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties