1-(p-Carboxyphenyl)-3-methyl-4-(p-hydroxybenzylidene)-2-pyrazolin-5-one

HCID 726599
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Basic information

CAS
77666-73-0
Standard SMILES
CC1=NN(c2ccc(C(=O)O)cc2)C(=O)C1=Cc1ccc(O)cc1
InChIKey
JWHGXMAVIMEDSS-UHFFFAOYSA-N
Molecular formula
C18H14N2O4
Average molar mass
322.3 g/mol

Names & identifiers

Preferred name
1-(p-Carboxyphenyl)-3-methyl-4-(p-hydroxybenzylidene)-2-pyrazolin-5-one
IUPAC
4-[4-[(4-hydroxyphenyl)methylidene]-3-methyl-5-oxopyrazol-1-yl]benzoic acid

Names & synonyms

77666-73-0CBMicro_034879SCHEMBL443203JWHGXMAVIMEDSS-UHFFFAOYSA-NNS000585341-(p-carboxyphenyl)-3-methyl-4-(p-hydroxybenzylidene)-2-pyrazolin-5-one

Database identifiers

CAS
77666-73-0
PubChem CID
726599
EC Number
278-746-3

Properties

Computed structural propertiesFilling in

XLogP
2.6
Topological polar surface area
90.2 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
24

Related reactions

1 records
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Compound notes

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