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973-21-7

973-21-7 structural image
Product Name: DINOBUTON
Formula: C14H18N2O7
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Pale yellow solid; [HSDB] Yellowish crystalline solid; [MSDSonline]
Color/Form CRYSTALS FROM METHANOL OR PETROLEUM ETHER
Melting Point 56-57 °C
Solubility SOL IN ALIPHATIC HYDROCARBONS, ETHANOL, FATTY OILS; HIGHLY SOL IN LOWER ALIPHATIC KETONES, AROMATIC HYDROCARBONS
Vapor Pressure 0.0000011 [mmHg]
Corrosivity Non-corrosive
Kovats Retention Index 2075.2 2077.1
Other Experimental Properties HYDROLYZED BY ALKALI TO PARENT PHENOL DINOSEB
Chemical Classes Pesticides -> Other Insecticides

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Environment
GHS09
GHS Hazard Statements H301:Acute toxicity,oral
H330:Acute toxicity,inhalation
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P271:Use only outdoors or in a well-ventilated area.
P273:Avoid release to the environment.

COMPUTED DESCRIPTORS

Molecular Weight 326.30 g/mol
XLogP3 4.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 6
Exact Mass 326.11140092 g/mol
Monoisotopic Mass 326.11140092 g/mol
Topological Polar Surface Area 127 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 443
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Dinobuton is a C-nitro compound.