4-[2-(4-Hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol structure

4-[2-(4-Hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol

4-[2-(4-hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol

Also Known As: XGDRLUOCCGMFEF-UHFFFAOYSA-|4,4'-Isopropylidenebis(2,6-dinitrophenol)|4-[2-(4-hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol|2,2-bis(3,5-dinitro-4-hydroxyphenyl) propane|4,4 -Isopropylidenebis(2,6-dinitrophenol)|AG-205/07449025|4,4'-(PROPANE-2,2-DIYL)BIS(2,6-DINITROPHENOL)|2,6,2',6'-Tetranitro-4,4'-isopropyliden-di-phenol|Phenol, 4,4'-(1-methylethylidene)bis[2,6-dinitro-|2,2',6,6'-tetranitro-4,4'-isopropylidene-bis-phenol|4-(1-{4-hydroxy-3,5-bisnitrophenyl}-1-methylethyl)-2,6-bisnitrophenol

CAS: 7239-54-5
Molecular Formula C15H12N4O10
Molecular Weight 408.05533 g/mol
LogP 4.4
Topological Polar Surface Area 224.0 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 10
Rotatable Bonds 2
Exact Mass 408.05533
Monoisotopic Mass 408.05533
Heavy Atoms 29
Complexity 575.0

Chemical Identifiers

CAS Number 7239-54-5
SMILES CC(C)(C1=CC(=C(C(=C1)[N+](=O)[O-])O)[N+](=O)[O-])C2=CC(=C(C(=C2)[N+](=O)[O-])O)[N+](=O)[O-]
InChIKey XGDRLUOCCGMFEF-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.

Organic Building Blocks (2 patents) Specialty Chemicals (3 patents)

Product Overview

4-[2-(4-Hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol (CAS 7239-54-5), with molecular formula C15H12N4O10 and molecular weight 408.05533 g/mol. IUPAC: 4-[2-(4-hydroxy-3,5-dinitrophenyl)propan-2-yl]-2,6-dinitrophenol.

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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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