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2-Cyclohexyl-4,6-Dinitrophenol

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2-Cyclohexyl-4,6-Dinitrophenol

EINECS 205-042-5
CAS No. 131-89-5 Density 1.381g/cm3
PSA 111.87000 LogP 4.30270
Solubility 15mg/L(25 oC) Melting Point 106°C
Formula C12H14 N2 O5 Boiling Point 320.9°Cat760mmHg
Molecular Weight 266.254 Flash Point 129.6°C
Transport Information N/A Appearance N/A
Safety A poison by ingestion, intraperitoneal, intravenous, subcutaneous, and possibly other routes. Moderately toxic by skin contact. A skin irritant. Fire hazard. See also NITRATES and PHENOLS. Can react with oxidizers. When heated to decomposition it emits toxic fumes of NOx. Risk Codes 23/24/25-50/53
Molecular Structure Molecular Structure of 131-89-5 (2-CYCLOHEXYL-4,6-DINITROPHENOL) Hazard Symbols
Synonyms

2,4-Dinitro-6-cyclohexylphenol;2-Cyclohexyl-4,6-dinitrophenol; 4,6-Dinitro-o-cyclohexylphenol; DN; DN(pesticide); DN 1; DNOCHP; Dinex; Dry Mix No. 1; NSC 403662; NSC 7739; SN 46

 

2-Cyclohexyl-4,6-Dinitrophenol Chemical Properties

Chemistry informtion about 2-Cyclohexyl-4,6-Dinitrophenol (CAS NO.131-89-5) is:
IUPAC Name: 2-Cyclohexyl-4,6-Dinitrophenol
Synonyms: 2,4-Dinitro-6-Cyclohexylphenol ; 2-Cyclohexyl-4,6-Dinitrofenol ; 2-Cyclohexyl-4,6-Dinitro-Pheno ; 4,6-Dinitro-O-Cyclohexylphenol ; 6-Cicloesil-2,4-Dinitr-Fenolo ; 6-Cyclohexyl-2,4-Dinitro-Pheno ; 6-Cyclohexyl-2,4-Dinitrophenol ; Dinitro-O-Cyclohexylphenol
MF: C12H14N2O5
MW: 266.25
EINECS: 205-042-5 
Density: 1.381 g/cm3
Flash Point: 129.6 °C
Boiling Point: 320.9 °C at 760 mmHg
Vapour Pressure: 0.000164 mmHg at 25°C 
Enthalpy of Vaporization: 58.5 kJ/mol
Following is the molecular structure of 2-Cyclohexyl-4,6-Dinitrophenol (CAS NO.131-89-5) is:

2-Cyclohexyl-4,6-Dinitrophenol Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
chicken LD50 oral 76mg/kg (76mg/kg)   National Technical Information Service. Vol. OTS0536145,
dog LDLo intravenous 8mg/kg (8mg/kg) cardiac: arrhythmias (including changes in conduction) lungs, thorax, or respiration: dyspnea Archives Internationales de Pharmacodynamie et de Therapie. Vol. 50, Pg. 20, 1935.
dog LDLo subcutaneous 20mg/kg (20mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 53, Pg. 58, 1935.
guinea pig LD50 oral 50mg/kg (50mg/kg)   Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 417, 1966.
guinea pig LDLo skin 1gm/kg (1000mg/kg)   Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 417, 1966.
guinea pig LDLo subcutaneous 20mg/kg (20mg/kg)   Pesticide Chemicals Official Compendium, Association of the American Pesticide Control Officials, Inc., 1966. Vol. -, Pg. 417, 1966.
mammal (species unspecified) LD50 unreported 50mg/kg (50mg/kg)   "Chemistry of Pesticides," Melnikov, N.N., New York, Springer-Verlag New York, Inc., 1971Vol. -, Pg. 101, 1971.
mouse LD50 intraperitoneal 25mg/kg (25mg/kg)   Biochemical Pharmacology. Vol. 18, Pg. 1389, 1969.
mouse LD50 oral 50mg/kg (50mg/kg)   "Wirksubstanzen der Pflanzenschutz und Schadlingsbekampfungsmittel," Perkow, W., Berlin, Verlag Paul Parey, 1971-1976Vol. -, Pg. -, 1971/1976.
mouse LDLo subcutaneous 30mg/kg (30mg/kg) lungs, thorax, or respiration: other changes University of California, Berkeley, Publications in Pharmacology. Vol. 1, Pg. 151, 1939.
pigeon LD50 intramuscular 8mg/kg (8mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 53, Pg. 58, 1935.
pigeon LDLo intravenous 7mg/kg (7mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 50, Pg. 20, 1935.
rabbit LD50 oral 81mg/kg (81mg/kg)   National Technical Information Service. Vol. OTS0536145,
rabbit LDLo subcutaneous 40mg/kg (40mg/kg) behavioral: convulsions or effect on seizure threshold lungs, thorax, or respiration: other changes University of California, Berkeley, Publications in Pharmacology. Vol. 1, Pg. 151, 1939.
rat LD50 oral 65mg/kg (65mg/kg)   Agricultural Research Service, USDA Information Memorandum. Vol. 20, Pg. 9, 1966.

2-Cyclohexyl-4,6-Dinitrophenol Safety Profile

A poison by ingestion, intraperitoneal, intravenous, subcutaneous, and possibly other routes. Moderately toxic by skin contact. A skin irritant. Fire hazard. See also NITRATES and PHENOLS. Can react with oxidizers. When heated to decomposition it emits toxic fumes of NOx
Hazard Codes:
ToxicT
DangerousN
Risk Statements:
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed. 
R50/53:Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Safety Statements:
S13:Keep away from food, drink and animal foodstuffs. 
S45:In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) 
S60:This material and its container must be disposed of as hazardous waste. 
S61:Avoid release to the environment. Refer to special instructions / safety data sheets.
RIDADR: 2779
HazardClass: 6.1(b)
PackingGroup: III

2-Cyclohexyl-4,6-Dinitrophenol Specification

2-Cyclohexyl-4,6-Dinitrophenol (CAS NO.131-89-5) is a yellow crystals.It reacts with oxidizing materials and combustibles [USCG, 1999]. Special Hazards of Combustion Products: Can detonate or explode when heated under confinement [USCG, 1999]. Aromatic nitro compounds, such as 2-Cyclohexyl-4,6-Dinitrophenol , range from slight to strong oxidizing agents. If mixed with reducing agents, including hydrides, sulfides and nitrides, they may begin a vigorous reaction that culminates in a detonation. The aromatic nitro compounds may explode in the presence of a base such as sodium hydroxide or potassium hydroxide even in the presence of water or organic solvents. The explosive tendencies of aromatic nitro compounds are increased by the presence of multiple nitro groups. Phenols do not behave as organic alcohols, as one might guess from the presence of a hydroxyl (-OH) group in their structure. Instead, they react as weak organic acids. Phenols and cresols are much weaker as acids than common carboxylic acids (phenol has Ka = 1.3 x 10^[-10]). These materials are incompatible with strong reducing substances such as hydrides, nitrides, alkali metals, and sulfides. Flammable gas (H2) is often generated, and the heat of the reaction may ignite the gas. Heat is also generated by the acid-base reaction between phenols and bases. It liver damage, metabolic stimulant, dermatitis, dilation of pupils.

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