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117-84-0

Basic Information
CAS No.: 117-84-0
Name: DI-N-OCTYL PHTHALATE
Article Data: 35
Molecular Structure:
Molecular Structure of 117-84-0 (DI-N-OCTYL PHTHALATE)
Formula: C24H38O4
Molecular Weight: 390.563
Synonyms: 1,2-Benzenedicarboxylicacid, dioctyl ester (9CI);Phthalic acid, dioctyl ester (6CI,8CI);Bis(n-octyl)phthalate;DNOP;Di-n-octyl phthalate;Dicapryl phthalate;Dinopol NOP;Dioctylo-phthalate;Monocizer W 555;NSC 15318;Octyl phthalate;Phthalic acid dioctylester;Vinycizer 85;n-Octyl phthalate;Di-n-octyl o-phthalate;1,2-Benzenedicarboxylicacid, 1,2-dioctyl ester;n-Dioctyl phthalate;
EINECS: 204-214-7
Density: 0.985 g/cm
Melting Point: -25 °C
Boiling Point: 416.4 °C at 760 mmHg
Flash Point: 222.3 °C
Solubility: 0.02 mg/L at 25 ℃
Appearance: clear liquid with a mild odor
Hazard Symbols: Xi
Risk Codes: 60-61
Safety: 23-24/25
Transport Information: UN 3082
PSA: 52.60000
LogP: 6.72120
Synthetic route
85-44-9

phthalic anhydride

111-87-5

octanol

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
zirconium(IV) oxide at 200℃; for 2h; in autoclave;99%
With Solid superacid catalyst at 200℃; under 375.038 - 4500.45 Torr; Temperature; Reagent/catalyst; Concentration;98%
With sulfonated graphene In toluene at 112℃; for 6h;95%
111-87-5

octanol

643-79-8

o-phthalic dicarboxaldehyde

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With tert.-butylhydroperoxide In decane at 25℃; for 6h; Inert atmosphere;96%
With tert.-butylhydroperoxide In decane; acetonitrile at 25℃; for 6h;96%
85-44-9

phthalic anhydride

111-87-5

octanol

A

117-84-0

Di-n-octyl phthalate

B

5393-19-1

Mono-n-octyl phthalate

Conditions
ConditionsYield
With montmorillonite K-10 In tetrachloromethane at 76℃; for 12h;A 21%
B 54%
111-87-5

octanol

84-66-2

Diethyl phthalate

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With sodium
111-87-5

octanol

88-99-3

benzene-1,2-dicarboxylic acid

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With toluene-4-sulfonic acid; xylene
With sulfated zirconia In neat (no solvent) at 160℃; for 6h; Kinetics; Reagent/catalyst; Temperature; Dean-Stark;
111-83-1

1-bromo-octane

88-99-3

benzene-1,2-dicarboxylic acid

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With potassium hydroxide; tetrabutylammomium bromide 1.) 60 deg C, 0.1 Torr, 6 h, 2.) 85 deg C, 16 h; Yield given. Multistep reaction;
111-87-5

octanol

phthalic acid-anhydride(?)

phthalic acid-anhydride(?)

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With toluene-4-sulfonic acid; xylene
N-dimethylamine

N-dimethylamine

octyl sodium phthalate

111-83-1

1-bromo-octane

88-99-3

benzene-1,2-dicarboxylic acid

117-84-0

Di-n-octyl phthalate

Conditions
ConditionsYield
With sodium hydroxide
142-82-5

n-heptane

A

129-00-0

pyrene

B

91-20-3

naphthalene

C

92-52-4

biphenyl

D

612-94-2

2-phenylnaphthalene

E

85-01-8

phenanthrene

F

120-12-7

anthracene

G

206-44-0

fluoranthene

H

117-84-0

Di-n-octyl phthalate

I

83-32-9

acenaphthene

J

208-96-8

acenaphthylene

Conditions
ConditionsYield
Mechanism; Microwave irradiation;
117-84-0

Di-n-octyl phthalate

84-71-9

Bis(2-ethylhexyl) cyclohexane-1,2-dicarboxylate

Conditions
ConditionsYield
With hydrogen In hexane at 150℃; under 37503.8 Torr; for 1h; Reagent/catalyst; Autoclave;98%
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  • CAS No.117-84-0	DI-N-OCTYL PHTHALATE

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  • n-Dioctyl phthalate CAS NO.117-84-0 CAS NO.117-84-0

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    117-84-0

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Chemistry


IUPAC Name: Dioctyl benzene-1,2-dicarboxylate
Molecular Formula: C24H38O4
Molecular Weight: 390.56 g/mol
EINECS: 204-214-7
Classification Code: Reproductive Effect; Skin / Eye Irritant
Index of Refraction: 1.49 
Molar Refractivity: 114.65 cm3 
Molar Volume: 396.3 cm3
Surface Tension: 36.4 dyne/cm 
Density: 0.985 g/cm
Flash Point: 222.3 °C 
Enthalpy of Vaporization: 66.96 kJ/mol 
Boiling Point: 416.4 °C at 760 mmHg 
Vapour Pressure of n-Dioctyl phthalate (CAS NO.117-84-0): 3.84E-07 mmHg at 25 °C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 skin > 5gm/kg (5000mg/kg)   "Industrial Hygiene and Toxicology," 2nd ed., Patty, F.A., ed., New York, John Wiley & Sons, Inc., 1958-63Vol. 2, Pg. 1906, 1963.
mouse LD50 intraperitoneal 65gm/kg (65000mg/kg)   Journal of the Society of Cosmetic Chemists. Vol. 28, Pg. 667, 1977.
mouse LD50 oral 6513mg/kg (6513mg/kg)   Gigiena Truda i Professional'nye Zabolevaniya. Labor Hygiene and Occupational Diseases. Vol. 17(11), Pg. 51, 1973.
rat LD50 intraperitoneal > 50mL/kg (50mL/kg)   Journal of Pharmaceutical Sciences. Vol. 61, Pg. 51, 1972.
rat LD50 oral 47gm/kg (47000mg/kg)   Farmakologiya i Toksikologiya Vol. 39, Pg. 635, 1976.

Consensus Reports

 n-Dioctyl phthalate's reported in EPA TSCA Inventory.

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.
Risk Statements: 60-61 
R60:May impair fertility. 
R61:May cause harm to the unborn child.
Safety Statements: 23-24/25 
S23:Do not breathe vapour. 
S24/25:Avoid contact with skin and eyes.
RIDADR: 2810
WGK Germany: 2
RTECS: TI1925000

Specification

  n-Dioctyl phthalate (CAS NO.117-84-0), its Synonyms are 1,2-Benzenedicarbonic acid, dioctyl ester ; 1,2-Benzenedicarboxylic acid, dioctyl ester ; Benzenedicarboxylic acid di-n-octyl ester ; Di-n-octyl phthalate ; Dicapryl phthalate ; Dinopol NOP ; Dioctyl 1,2-benzenedicarboxylate ; Dioctyl o-benzenedicarboxylate ; Dioctyl phthalate ; Dioktylester kyseliny ftalove ; n-Octyl phthalate ; o-Benzenedicarboxylic acid, dioctyl ester . It is clear liquid with a mild odor.