AC1OAAEF structure

AC1OAAEF

4-[(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one

Also Known As: BAS 00513629|UPCMLD0ENAT0500-2902:001|AG-690/36991078|4-[(2-hydroxy-3,5-diiodobenzylidene)amino]-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one|4-[(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-one|4-[(Z)-[(2-HYDROXY-3,5-DIIODOPHENYL)METHYLIDENE]AMINO]-1,5-DIMETHYL-2-PHENYL-2,3-DIHYDRO-1H-PYRAZOL-3-ONE|4-[(1E)-2-(2-hydroxy-3,5-diiodophenyl)-1-azavinyl]-2,3-dimethyl-1-phenyl-3-pyr azolin-5-one|4-[(3,5-diiodo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1,5-dimethyl-2-phenylpyrazol-3-one|4-[[(E)-(3,5-diiodo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]-1,5-dimethyl-2-phenylpyrazol-3-one

CAS: 300697-06-7
Molecular Formula C18H15I2N3O2
Molecular Weight 558.92535 g/mol
LogP 4.14982
Topological Polar Surface Area 59.52 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 558.92535
Monoisotopic Mass 558.92535
Heavy Atoms 25
Complexity 1021.0358

Chemical Identifiers

CAS Number 300697-06-7
SMILES CC1=C(C(=O)N(N1C)C2=CC=CC=C2)N=CC3=C(C(=CC(=C3)I)I)O

Product Overview

AC1OAAEF (CAS 300697-06-7), with molecular formula C18H15I2N3O2 and molecular weight 558.92535 g/mol. IUPAC: 4-[(2-hydroxy-3,5-diiodophenyl)methylideneamino]-1,5-dimethyl-2-phenylpyrazol-3-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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