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Home Halogens 1-(4-chlorophenyl)-3,4-dimethylpyrano[2,3-c]pyrazol-6(1H)-one

1-(4-chlorophenyl)-3,4-dimethylpyrano[2,3-c]pyrazol-6(1H)-one

CAS No.:
74169-54-3
Catalog Number:
AG01FLFO
Molecular Formula:
C14H11ClN2O2
Molecular Weight:
274.7023
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Product Description
Catalog Number:
AG01FLFO
Chemical Name:
1-(4-chlorophenyl)-3,4-dimethylpyrano[2,3-c]pyrazol-6(1H)-one
CAS Number:
74169-54-3
Molecular Formula:
C14H11ClN2O2
Molecular Weight:
274.7023
MDL Number:
MFCD00638621
IUPAC Name:
1-(4-chlorophenyl)-3,4-dimethylpyrano[2,3-c]pyrazol-6-one
InChI:
InChI=1S/C14H11ClN2O2/c1-8-7-12(18)19-14-13(8)9(2)16-17(14)11-5-3-10(15)4-6-11/h3-7H,1-2H3
InChI Key:
YUUPOEIPCKZQSL-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)n1nc(c2c1oc(=O)cc2C)C
Properties
Complexity:
404  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.051g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.704g/mol
Monoisotopic Mass:
274.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
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