Home Aldehydes 3-(4-Methoxyphenyl)-1-phenyl-1h-pyrazole-4-carbaldehyde

3-(4-Methoxyphenyl)-1-phenyl-1h-pyrazole-4-carbaldehyde

CAS No.:
36640-42-3
Catalog Number:
AG00C8OR
Molecular Formula:
C17H14N2O2
Molecular Weight:
278.3053
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
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United States
$96
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Product Description
Catalog Number:
AG00C8OR
Chemical Name:
3-(4-Methoxyphenyl)-1-phenyl-1h-pyrazole-4-carbaldehyde
CAS Number:
36640-42-3
Molecular Formula:
C17H14N2O2
Molecular Weight:
278.3053
MDL Number:
MFCD01131646
IUPAC Name:
3-(4-methoxyphenyl)-1-phenylpyrazole-4-carbaldehyde
InChI:
InChI=1S/C17H14N2O2/c1-21-16-9-7-13(8-10-16)17-14(12-20)11-19(18-17)15-5-3-2-4-6-15/h2-12H,1H3
InChI Key:
KGEVSOCXYXEMSM-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1ccc(cc1)OC)c1ccccc1
Properties
Complexity:
336  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.106g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.311g/mol
Monoisotopic Mass:
278.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Literature
Title Journal
3-(4-Meth-oxy-phen-yl)-1-phenyl-1H-pyrazole-4-carbaldehyde. Acta crystallographica. Section E, Structure reports online 20111101
(E)-1-(2,4-Dichloro-phen-yl)-3-[3-(4-meth-oxy-phen-yl)-1-phenyl-1H-pyrazol-4-yl]prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20111101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties