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Home Aldehydes 1-benzyl-3-(4-ethylphenyl)-1H-pyrazole-4-carbaldehyde

1-benzyl-3-(4-ethylphenyl)-1H-pyrazole-4-carbaldehyde

CAS No.:
956513-35-2
Catalog Number:
AG019NQV
Molecular Formula:
C19H18N2O
Molecular Weight:
290.3590
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Product Description
Catalog Number:
AG019NQV
Chemical Name:
1-benzyl-3-(4-ethylphenyl)-1H-pyrazole-4-carbaldehyde
CAS Number:
956513-35-2
Molecular Formula:
C19H18N2O
Molecular Weight:
290.3590
MDL Number:
MFCD06368758
IUPAC Name:
1-benzyl-3-(4-ethylphenyl)pyrazole-4-carbaldehyde
InChI:
InChI=1S/C19H18N2O/c1-2-15-8-10-17(11-9-15)19-18(14-22)13-21(20-19)12-16-6-4-3-5-7-16/h3-11,13-14H,2,12H2,1H3
InChI Key:
RRDFHGPQEZKYNR-UHFFFAOYSA-N
SMILES:
O=Cc1cn(nc1c1ccc(cc1)CC)Cc1ccccc1
Properties
Complexity:
345  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.142g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
290.366g/mol
Monoisotopic Mass:
290.142g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
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