Home Halogens 1-[4-chloro-3-(4-chlorophenyl)phenyl]-2,3-dihydro-1H-pyrazol-3-one

1-[4-chloro-3-(4-chlorophenyl)phenyl]-2,3-dihydro-1H-pyrazol-3-one

CAS No.:
2138424-49-2
Catalog Number:
AG01EIN6
Molecular Formula:
C15H10Cl2N2O
Molecular Weight:
305.1587
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Product Description
Catalog Number:
AG01EIN6
Chemical Name:
1-[4-chloro-3-(4-chlorophenyl)phenyl]-2,3-dihydro-1H-pyrazol-3-one
CAS Number:
2138424-49-2
Molecular Formula:
C15H10Cl2N2O
Molecular Weight:
305.1587
MDL Number:
MFCD31442885
IUPAC Name:
2-[4-chloro-3-(4-chlorophenyl)phenyl]-1H-pyrazol-5-one
InChI:
InChI=1S/C15H10Cl2N2O/c16-11-3-1-10(2-4-11)13-9-12(5-6-14(13)17)19-8-7-15(20)18-19/h1-9H,(H,18,20)
InChI Key:
RHTXZZQQOLEYRU-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1cc(ccc1Cl)n1ccc(=O)[nH]1
Properties
Complexity:
393  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.017g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.158g/mol
Monoisotopic Mass:
304.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3  
Properties