Home Halogens 2-[5-amino-3-(4-chlorophenyl)-1H-pyrazol-1-yl]ethan-1-ol

2-[5-amino-3-(4-chlorophenyl)-1H-pyrazol-1-yl]ethan-1-ol

CAS No.:
926188-04-7
Catalog Number:
AG01AA0W
Molecular Formula:
C11H12ClN3O
Molecular Weight:
237.6855
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Product Description
Catalog Number:
AG01AA0W
Chemical Name:
2-[5-amino-3-(4-chlorophenyl)-1H-pyrazol-1-yl]ethan-1-ol
CAS Number:
926188-04-7
Molecular Formula:
C11H12ClN3O
Molecular Weight:
237.6855
MDL Number:
MFCD08443210
IUPAC Name:
2-[5-amino-3-(4-chlorophenyl)pyrazol-1-yl]ethanol
InChI:
InChI=1S/C11H12ClN3O/c12-9-3-1-8(2-4-9)10-7-11(13)15(14-10)5-6-16/h1-4,7,16H,5-6,13H2
InChI Key:
LQWMCHPLHSXJRF-UHFFFAOYSA-N
SMILES:
OCCn1nc(cc1N)c1ccc(cc1)Cl
Properties
Complexity:
221  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.687g/mol
Monoisotopic Mass:
237.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
64.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties