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92-93-3

92-93-3 structural image
Product Name: 4-Nitrobiphenyl
Formula: C12H9NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 4-nitrobiphenyl is a white to yellow needle-like crystalline solid with a sweetish odor. (NIOSH, 2022)
Color/Form YELLOW NEEDLES FROM ALC
Odor SWEETISH ODOR
Boiling Point 644 °F at 760 mmHg (NIOSH, 2023)
Melting Point 237 °F (NIOSH, 2023)
Flash Point 290 °F (NIOSH, 2023)
Solubility Insoluble (NIOSH, 2023)
LogP 3.77
Decomposition When heated to decomp it emits toxic fumes of /nitrogen oxides/.
Kovats Retention Index 1832 1834 1816 1856 1839 1834 312.3
Other Experimental Properties UV: 373 (Sadtler Research Laboratories Spectral Collection) /Biphenyl, 2-nitro/
Chemical Classes Nitrogen Compounds -> Nitros, Aromatic

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H350:Carcinogenicity
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 199.20 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 199.063328530 g/mol
Monoisotopic Mass 199.063328530 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 210
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

4-nitrobiphenyl is a white to yellow needle-like crystalline solid with a sweetish odor. (NIOSH, 2022)