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618-71-3

618-71-3 structural image
Product Name: ETHYL 3,5-DINITROBENZOATE
Formula: C9H8N2O6
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1755 1757 1760 1767 1781 1810 1752 1762 1777 1761.4 1761

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H302:Acute toxicity,oral
Precautionary Statement Codes P262:Do not get in eyes, on skin, or on clothing.

COMPUTED DESCRIPTORS

Molecular Weight 240.17 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 3
Exact Mass 240.03823598 g/mol
Monoisotopic Mass 240.03823598 g/mol
Topological Polar Surface Area 118 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 298
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes