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  Product Detail  Dioctyl phthalate Basic information
Product Name: Dioctyl phthalate
Synonyms: 1,2-Benzenedicarbonic acid, dioctyl ester;1,2-Benzenedicarbonicacid,dioctylester;1,2-Benzenedicarboxylic acid, dioctyl ester;1,2-Benzenedicarboxylicacid,dioctylester;ai3-15071(usda);benzenedicarboxylicaciddi-n-octylester;Celluflex dop;celluflexdop
CAS: 117-84-0
MF: C24H38O4
MW: 390.56
EINECS: 204-214-7
Product Categories: Aromatics;Intermediates & Fine Chemicals;Phthalates;Functional Materials;Phthalates (Plasticizer);Pharmaceuticals;Plasticizer;solvent;117-84-0;1;DOP
Mol File: 117-84-0.mol
Dioctyl phthalate Structure
Dioctyl phthalate Chemical Properties
Melting point -25℃
Boiling point 380 °C
density 0.980 g/mL at 20 °C(lit.)
vapor pressure 5(x 10-8 mmHg) at 82 °C, 500 at 132 °C (Gross and Colony, 1973)
refractive index n20/D 1.485
Fp 219 °C
storage temp. 2-8°C
solubility Chloroform (Slightly), Methanol (Slightly)
form Oily Liquid
color Colourless
Specific Gravity 0.98
Water Solubility Insoluble in water.
Merck 14,2864
BRN 1915994
Henry's Law Constant 1.41(x 10-12 atmm3/mol) at 25 °C (approximate - calculated from water solubility and vapor pressure)
Dielectric constant 5.1（24℃）
Major Application cleaning products
cosmetics
food and beverages
personal care
InChI 1S/C24H38O4/c1-3-5-7-9-11-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20-16-12-10-8-6-4-2/h13-14,17-18H,3-12,15-16,19-20H2,1-2H3
InChIKey MQIUGAXCHLFZKX-UHFFFAOYSA-N
SMILES CCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCC
CAS DataBase Reference 117-84-0(CAS DataBase Reference)
NIST Chemistry Reference Di-n-octyl phthalate(117-84-0)
EPA Substance Registry System Di-n-octyl phthalate (117-84-0)
Safety Information
Risk Statements 60-61
Safety Statements 23-24/25
RIDADR 2810
WGK Germany 2
RTECS TI1925000
TSCA TSCA listed
HS Code 29173200
Storage Class 10 - Combustible liquids
Hazard Classifications Aquatic Chronic 4
Hazardous Substances Data 117-84-0(Hazardous Substances Data)
Toxicity Acute oral LD50 for mice 6,513 mg/kg (quoted, RTECS, 1985):rats 13,000 mg/kg (Dogra et al., 1989):mice 1,250-1,954 mg/kg (Etnier, 1987).
MSDS Information
Provider Language
SigmaAldrich English
ALFA English
Dioctyl phthalate Usage And Synthesis
Description Dioctyl phthalate (DNOP), also known as Di-n-octyl phthalate, is a colourless or pale yellow transparent liquid with a distinctive odour. It has a boiling point of 386 °C and a relative density of 0.980–0.983 (20/4 °C). It is insoluble in water but soluble in organic solvents such as ethanol and diethyl ether. It is one of the most widely used plasticisers in plastics processing.
Chemical Properties Colorless liquid
Physical properties Clear, light colored, viscous, oily liquid with a slight odor
Uses Dioctyl phthalate is used as a plasticizer in various plastic materials.
Uses Di-n-octyl phthalate is used as a plasticizer for many resins and elastomers. It acts as an additive. It is also used for medical tubing and blood storage bags, wire and cables, carpet back coating, floor tile and in cosmetics.
Uses Phthalate ester used as plasticizers and additives. Used in toxicology studies as well as risk assessment studies of food contamination that occurs via migration of phthalates into foodstuffs from food-contact materials (FCM).
Definition ChEBI: Di-n-octyl phthalate is a phthalate ester and a diester.
General Description A clear liquid with a mild odor. Slightly less dense than water and insoluble in water. Hence floats on water. Flash point 430°F. The primary hazard is the threat to the environment. Immediate steps should be taken to limit its spread to the environment. As a liquid, can easily penetrate the soil and contaminate groundwater and nearby streams. Eye contact may produce severe irritation and direct skin contact may produce mild irritation. Used in the manufacture of a variety of plastics and coating products.
Air & Water Reactions Insoluble in water.
Reactivity Profile DI-N-OCTYL PHTHALATE reacts with acids to liberate heat along with alcohols and acids. Strong oxidizing acids may cause a vigorous reaction that is sufficiently exothermic to ignite the reaction products. Heat is also generated by the interaction with caustic solutions. Flammable hydrogen may be generated by mixing with alkali metals and hydrides. Can generate electrostatic charges by swirling or pouring [Handling Chemicals Safely, 1980. p. 250].
Health Hazard Produces no ill effects at normal temperatures but may give off irritating vapor at high temperature.
Health Hazard The acute oral toxicity is very low. Inges tion may result in nausea, somnolence, hallucination, and lacrimation. In humans, sucheffects may be noted at a dose level of150–200 mg/kg. The recovery is prompt.The oral LD50 value in mice is in the range6500 mg/kg. Its irritant action on the skinand the eyes of rabbits was mild. Di-n-octylphthalate fed to mice at the 5% level in dietshowed no reproductive toxicity.
Fire Hazard Special Hazards of Combustion Products: None
Safety Profile Mildly toxic by ingestion. Experimental teratogenic and reproductive effects. A skin and severe eye irritant. Used as a plasticizer. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.
First aid If this chemical gets into the eyes, remove any contact lenses at once and irrigate immediately for at least15 min, occasionally lifting upper and lower lids. Seek medical attention immediately. If this chemical contacts the skin,remove contaminated clothing and wash immediately withsoap and water. Seek medical attention immediately. If thischemical has been inhaled, remove from exposure, begin rescue breathing (using universal precautions, including resuscitation mask) if breathing has stopped and CPR if heart actionhas stopped. Transfer promptly to a medical facility. Whenthis chemical has been swallowed, get medical attention.Give large quantities of water and induce vomiting. Do notmake an unconscious person vomit.
Source Detected in distilled water-soluble fractions of new and used motor oil at concentrations of 1.3 to 1.4 and 73 to 78 μg/L, respectively (Chen et al., 1994). May leach from plastic products (e.g., tubing, containers) used in laboratories during chemical analysis of aqueous samples.
Environmental fate Biological. o-Phthalic acid was tentatively identified as the major degradation product of di-noctyl phthalate produced by the bacterium Serratia marcescens (Mathur and Rouatt, 1975). When di-n-octyl phthalate was statically incubated in the dark at 25 °C with yeast extract and settled domestic wastewater inoculum, no degradation was observed after 7 d. In a 21-d period, however, gradual adaptation did occur, resulting in 94 and 93% losses at concentrations of 5 and 10 mg/L, respectively (Tabak et al., 1981). In the presence of suspended natural populations from unpolluted aquatic systems, the second-order microbial transformation rate constant determined in the laboratory was reported to be 3.7 ± 0.6 x 10-13 L/organismh (Steen, 1991).
Chemical/Physical. Under alkaline conditions, di-n-octyl phthalate will initially hydrolyze to noctyl hydrogen phthalate and 1-octanol. The monoester will undergo hydrolysis forming ophthalic acid and 1-octanol (Kollig, 1993). The hydrolysis half-life at pH 7 and 25 °C was estimated to be 107 yr (Ellington et al., 1988).
storage Color Code—Green: General storage may be used.Prior to working with this chemical you should be trainedon its proper handling and storage. Before entering confinedspace where this chemical may be present, check to makesure that an explosive concentration does not exist. Di-noctyl phthalate must be stored to avoid contact with strongoxidizers (such as chlorine, bromine, and fluorine) andstrong acids (such as hydrochloric, sulfuric, and nitric); andalkyl halides, since violent reactions occur. Store in tightlyclosed containers in a cool, well-ventilated area away fromheat. Sources of ignition, such as smoking and open flames,are prohibited where this chemical is used, handled, orstored in a manner that could create a potential fire orexplosion hazard. Metal containers involving the transfer of5 gallons or more of this chemical should be grounded andbonded. Drums must be equipped with self-closing valves,pressure vacuum bungs, and flame arresters. Use only nonsparking tools and equipment, especially when opening andclosing containers of this chemical.
Shipping The name of this material is not in the DOT listof materials for label and packaging standards. However,based on regulations, it may be classified as anEnvironmentally hazardous substances, liquid, n.o.s. It fallsin Hazard Class 9 and Packing Group III.[20,21]
Toxics Screening Level The initial threshold screening level (ITSL) for di-n-octyl phthalate (DnOP) is 470 μg/m3 based on an annual averaging time.
Dioctyl phthalate Preparation Products And Raw materials
Raw materials Sulfuric acid-->Sodium carbonate-->Phthalic anhydride-->2-Ethylhexanol-->1-Octanol-->Phthalic acid