AC1O1DJM structure

AC1O1DJM

5-(2-hydroxyethyl)-3-(2-hydroxy-5-methylphenyl)-4-(3-hydroxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one

Also Known As: (3Z)-5-(2-hydroxyethyl)-4-(3-hydroxyphenyl)-3-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one|3-(2-hydroxy-5-methylphenyl)-5-(2-hydroxyethyl)-4-(3-hydroxyphenyl)-1H,4H,5H,6H-pyrrolo[3,4-c]pyrazol-6-one|3-(2-hydroxy-5-methylphenyl)-5-(2-hydroxyethyl)-4-(3-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one|5-(2-hydroxyethyl)-3-(2-hydroxy-5-methylphenyl)-4-(3-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(1H)-one|5-(2-hydroxyethyl)-3-(2-hydroxy-5-methylphenyl)-4-(3-hydroxyphenyl)-4,5-dihydropyrrolo[3,4-c]pyrazol-6(2H)-one|5-(2-hydroxyethyl)-4-(3-hydroxyphenyl)-3-(3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,4-dihydro-1H-pyrrolo[3,4-c]pyrazol-6-one

CAS: 880784-29-2
Molecular Formula C20H19N3O4
Molecular Weight 365.13754 g/mol
LogP 2.33382
Topological Polar Surface Area 109.68 Ų
Hydrogen Bond Donors 4
Hydrogen Bond Acceptors 5
Rotatable Bonds 4
Exact Mass 365.13754
Monoisotopic Mass 365.13754
Heavy Atoms 27
Complexity 1027.8163

Chemical Identifiers

CAS Number 880784-29-2
SMILES CC1=CC(=C(C=C1)O)C2=NNC3=C2C(N(C3=O)CCO)C4=CC(=CC=C4)O

Product Overview

AC1O1DJM (CAS 880784-29-2), with molecular formula C20H19N3O4 and molecular weight 365.13754 g/mol. IUPAC: 5-(2-hydroxyethyl)-3-(2-hydroxy-5-methylphenyl)-4-(3-hydroxyphenyl)-1,4-dihydropyrrolo[3,4-d]pyrazol-6-one.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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