Phosphonic acid, (1,1-dichloroethyl)-, bis(5-methyl-2-nitrophenyl) ester structure

Phosphonic acid, (1,1-dichloroethyl)-, bis(5-methyl-2-nitrophenyl) ester

2-[1,1-dichloroethyl-(5-methyl-2-nitrophenoxy)phosphoryl]oxy-4-methyl-1-nitrobenzene

Also Known As: Phosphonic acid, (1,1-dichloroethyl)-, bis(5-methyl-2-nitrophenyl) ester|Bis(5-methyl-2-nitrophenyl) (1,1-dichloroethyl)phosphonate|2-[1,1-dichloroethyl-(5-methyl-2-nitrophenoxy)phosphoryl]oxy-4-methyl-1-nitrobenzene

CAS: 76569-06-7
Molecular Formula C16H15Cl2N2O7P
Molecular Weight 447.9994 g/mol
LogP 5.1
Topological Polar Surface Area 127.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 7
Rotatable Bonds 5
Exact Mass 447.9994
Monoisotopic Mass 447.9994
Heavy Atoms 28
Complexity 595.0

Chemical Identifiers

CAS Number 76569-06-7
SMILES CC1=CC(=C(C=C1)[N+](=O)[O-])OP(=O)(C(C)(Cl)Cl)OC2=C(C=CC(=C2)C)[N+](=O)[O-]
InChIKey OGBBBHGNTISQBK-UHFFFAOYSA-N

Product Overview

Phosphonic acid, (1,1-dichloroethyl)-, bis(5-methyl-2-nitrophenyl) ester (CAS 76569-06-7), with molecular formula C16H15Cl2N2O7P and molecular weight 447.9994 g/mol. IUPAC: 2-[1,1-dichloroethyl-(5-methyl-2-nitrophenoxy)phosphoryl]oxy-4-methyl-1-nitrobenzene.

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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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