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71607-49-3

71607-49-3 structural image
Product Name: 1,5(or 1,8)-dinitronaphthalene
Formula: C10H6N2O4
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Yellowish white needles or light yellow fluffy solid. (NTP, 1992)
Boiling Point Sublimes (NTP, 1992)
Melting Point 421 to 423 °F (NTP, 1992)
Solubility less than 1 mg/mL at 68 °F (NTP, 1992)
Vapor Pressure 0.00000428 [mmHg]
Kovats Retention Index 325.7
Chemical Classes Nitrogen Compounds -> Nitros, Aromatic

COMPUTED DESCRIPTORS

Molecular Weight 218.17 g/mol
XLogP3 2.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 0
Exact Mass 218.03275668 g/mol
Monoisotopic Mass 218.03275668 g/mol
Topological Polar Surface Area 91.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 266
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

PRODUCT INTRODUCTION

description

Yellowish white needles or light yellow fluffy solid. (NTP, 1992)