1-Phenyl-heptan-4-one structure

1-Phenyl-heptan-4-one

N-[4-[(3-hydroxy-5-oxo-1,2-diphenylpyrazol-4-yl)diazenyl]phenyl]sulfonyl-4-propan-2-yloxybenzamide

Also Known As: 1-Phenyl-heptan-4-one|N-[4-[2-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-ylidene)hydrazinyl]phenyl]sulfonyl-4-propan-2-yloxy-benzamide|N-[4-[(3-Hydroxy-5-oxo-1,2-diphenylpyrazol-4-yl)diazenyl]phenyl]sulfonyl-4-propan-2-yloxybenzamide|N-[4-[2-(3,5-dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazinyl]phenyl]sulfonyl-4-propan-2-yloxybenzamide|N-({4-[2-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazino]phenyl}sulfonyl)-4-isopropoxybenzamide|N-[4-[2-(3,5-dioxo-1,2-diphenyl-pyrazolidin-4-ylidene)hydrazino]phenyl]sulfonyl-4-isopropoxy-benzamide|N-{4-[2-(3,5-Dioxo-1,2-diphenylpyrazolidin-4-ylidene)hydrazin-1-yl]benzene-1-sulfonyl}-4-[(propan-2-yl)oxy]benzamide

CAS: 59541-35-4
Molecular Formula C31H27N5O6S
Molecular Weight 597.1682 g/mol
LogP 6.2
Topological Polar Surface Area 149.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 9
Rotatable Bonds 9
Exact Mass 597.1682
Monoisotopic Mass 597.1682
Heavy Atoms 43
Complexity 1140.0

Chemical Identifiers

CAS Number 59541-35-4
SMILES CC(C)OC1=CC=C(C=C1)C(=O)NS(=O)(=O)C2=CC=C(C=C2)N=NC3=C(N(N(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)O
InChIKey ZJITYUYLFDQEPQ-UHFFFAOYSA-N

Product Overview

1-Phenyl-heptan-4-one (CAS 59541-35-4), with molecular formula C31H27N5O6S and molecular weight 597.1682 g/mol. IUPAC: N-[4-[(3-hydroxy-5-oxo-1,2-diphenylpyrazol-4-yl)diazenyl]phenyl]sulfonyl-4-propan-2-yloxybenzamide.

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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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