2',4'-Dihydroxychalcone

Formula:C15H12O3 CAS:1776-30-3 ChemrytIQ

PropertyValue
Casrn1776-30-3
MolName2',4'-Dihydroxychalcone
MolecularFormulaC15H12O3
SmilesOc1cc(O)c(/C=C/C(c2ccccc2)=O)cc1
InChIInChI=1S/C15H12O3/c16-13-8-6-12(15(18)10-13)7-9-14(17)11-4-2-1-3-5-11/h1-10,16,18H
InChIKLKNPFZQVNZFLIC-UHFFFAOYSA-N
CanonicalSyTyLFy8725691b6071f865
TotalMolweight240.257
Molweight240.257
MonoisotopicMass240.078645
CLogP2.6124
CLogS-3.248
H Acceptors3
H Donors2
TotalSurfaceArea189.97
Relative PSA0.20656
PolarSurfaceArea57.53
Druglikeness0.13358
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Nasty Functions
Shape Index0.66667
Molecula Flexibility0.34835
Molecular Complexity0.61487
Fragments1
Non HAtoms18
NonCHAtoms3
Electronegative Atoms3
Rotatable Bond3
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3Atoms2
Symmetricatoms2
StereoCon
CAS Number Mutagenic Tumorigenic Irritant Molecule Formula Mol Weight Druglikeness ChemrytIQ
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10001-51-1nonenonenoneC9H18N2O170.2555.9677 ChemrytIQ
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100-97-0highhighhighC6H12N4140.1891.5849 ChemrytIQ
100004-54-4nonehighnoneC4H8Te183.708-3.9699 ChemrytIQ
1000018-44-9nonenonenoneC13H16N2O5280.279-2.3885 ChemrytIQ
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100-59-4nonenonenoneCl.C6H5Mg101.411-2.3575 ChemrytIQ
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100-45-8nonenonehighC7H9N107.155-10.018 ChemrytIQ
1000339-25-2nonenonenoneC14H8N2OBrF319.133-1.9975 ChemrytIQ
100-74-3highnonehighC6H13NO115.1753.7593 ChemrytIQ
100-32-3nonenonenoneC12H8N2O4S2308.338-7.3436 ChemrytIQ
100019-40-7nonenonenoneC14H15NO3245.277-1.947 ChemrytIQ
100-66-3highnonehighC7H8O108.14-2.0846 ChemrytIQ
100008-36-4nonenonenoneC17H22O2258.36-5.6379 ChemrytIQ
1000000-13-4highhighhighC21H28O12472.441-0.17986 ChemrytIQ
1000269-51-1nonenonenoneC13H12NO4B257.052-12.285 ChemrytIQ
1000304-40-4nonenonenoneC11H17NO179.2622.2651 ChemrytIQ
1000-86-8nonenonenoneC7H1296.1723-10.397 ChemrytIQ
1000-00-6nonenonehighC10H26OSi2218.487-62.76 ChemrytIQ
100-20-9highnonelowC8H4O2Cl2203.024-10.706 ChemrytIQ
1000017-98-0nonenonenoneC8H4N2O2BrCl275.489-2.5326 ChemrytIQ
1000339-33-2nonenonenoneC10H11NClF199.6550.76 ChemrytIQ
1000018-49-4nonenonenoneC14H19NO5S313.3732.5797 ChemrytIQ
1000-22-2lowhighlowC6H14O2FPS200.213-11.052 ChemrytIQ
100-47-0highnonehighC7H5N103.124-6.0498 ChemrytIQ
1000335-27-2nonenonenoneC10H15N4OCl242.7090.81574 ChemrytIQ
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100009-99-2lowhighnoneC21H25NO4355.4332.9337 ChemrytIQ
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1000068-26-7nonenonenoneC13H15NO4BF279.074-46.077 ChemrytIQ
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100-50-5nonenonehighC7H10O110.155-9.6048 ChemrytIQ
1000198-76-4nonenonenoneC11H12NF3215.217-5.8988 ChemrytIQ
100-93-6highhighhighC19H18N2O2S338.43-12.848 ChemrytIQ
100004-81-7nonenonenoneC13H11NO3229.234-1.3547 ChemrytIQ
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