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119023-33-5 | 1H-Pyrazole, 5-chloro-4-[2-(3-chlorophenyl)diazenyl]-1,3-diphenyl-
CAS No: 119023-33-5 Catalog No: AG000P2M MDL No:
Product Description
Catalog Number:
AG000P2M
Chemical Name:
1H-Pyrazole, 5-chloro-4-[2-(3-chlorophenyl)diazenyl]-1,3-diphenyl-
CAS Number:
119023-33-5
Molecular Formula:
C21H14Cl2N4
Molecular Weight:
393.2687
IUPAC Name:
(5-chloro-1,3-diphenylpyrazol-4-yl)-(3-chlorophenyl)diazene
InChI:
InChI=1S/C21H14Cl2N4/c22-16-10-7-11-17(14-16)24-25-20-19(15-8-3-1-4-9-15)26-27(21(20)23)18-12-5-2-6-13-18/h1-14H
InChI Key:
ZCNYYUDMYKJAGE-UHFFFAOYSA-N
SMILES:
Clc1cccc(c1)N=Nc1c(nn(c1Cl)c1ccccc1)c1ccccc1
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
392.06g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.271g/mol
Monoisotopic Mass:
392.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6.9
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