ChemicalBook--->CAS DataBase List--->84-69-5

84-69-5

84-69-5 Structure

84-69-5 Structure
IdentificationMore
[Name]

Diisobutyl phthalate
[CAS]

84-69-5
[Synonyms]

1,2-benzenedicarboxylic acid bis(2-methylpropyl) ester
BIS(2-METHYLPROPYL)PHTHALATE
DIBP
DIISOBUTYL PHTHALATE
DI-ISO-BUTYL PHTHALATE-3,4,5,6-D4
DI-ISO-BUTYL PHTHALATE-D4
PHTHALIC ACID, BIS-ISO-BUTYL ESTER
PHTHALIC ACID DIISOBUTYL ESTER
Diisobutylester kyseliny ftalove
Hexaplas M/1B
Isobutyl phthalate
Kodaflex DIBP
Palatinol 1C
Palatinol IC
Uniplex 155
Diisobutyl o-phthalate
Diisobutylphthalate,99%
BIS(METHYL-PROPYL)PHTHALATE
DIISOBUTYLPHTHALATEESTER
Phthalsurediisobutylester
[EINECS(EC#)]

201-553-2
[Molecular Formula]

C16H22O4
[MDL Number]

MFCD01861606
[Molecular Weight]

278.34
[MOL File]

84-69-5.mol
Chemical PropertiesBack Directory
[Appearance]

clear liquid
[Melting point ]

-64 °C
[Boiling point ]

327 °C(lit.)
[density ]

1.039 g/mL at 25 °C(lit.)
[Pour Point ]

-45
[vapor pressure ]

11.2-1470Pa at 100℃
[refractive index ]

n20/D 1.49(lit.)
[Fp ]

>230 °F
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

neat
[color ]

Colorless to Light yellow
[Odor]

Practically odorless when pure
[Water Solubility ]

Insoluble
[FreezingPoint ]

-50℃
[BRN ]

2054802
[Henry's Law Constant]

3.5×100 mol/(m3Pa) at 25℃, HSDB (2015)
[InChI]

1S/C16H22O4/c1-11(2)9-19-15(17)13-7-5-6-8-14(13)16(18)20-10-12(3)4/h5-8,11-12H,9-10H2,1-4H3
[InChIKey]

MGWAVDBGNNKXQV-UHFFFAOYSA-N
[SMILES]

CC(C)COC(=O)c1ccccc1C(=O)OCC(C)C
[LogP]

4.11-4.45 at 20-30℃
[CAS DataBase Reference]

84-69-5(CAS DataBase Reference)
[NIST Chemistry Reference]

1,2-Benzenedicarboxylic acid, bis(2-methylpropyl) ester(84-69-5)
[EPA Substance Registry System]

84-69-5(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Health Hazard (GHS08)Environment (GHS09)
GHS08,GHS09
[Signal word ]

Danger
[Hazard statements ]

H360FD-H410
[Precautionary statements ]

P202-P273-P280-P308+P313-P391-P405
[Hazard Codes ]

N,Xn
[Risk Statements ]

R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R63:Possible risk of harm to the unborn child.
R62:Possible risk of impaired fertility.
[Safety Statements ]

S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

UN 3082 9/PG 3
[WGK Germany ]

2
[RTECS ]

TI1225000
[TSCA ]

Yes
[REACH Registrations]

Active
[HazardClass ]

9
[PackingGroup ]

III
[HS Code ]

29173400
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Aquatic Acute 1
Aquatic Chronic 1
Repr. 1B
[Safety Profile]

Moderately toxic by intraperitoneal route. Mdly toxic by ingestion and skin contact. Experimental teratogenic and reproductive effects. Combustible when exposed to heat or flame. To fight fire, use foam, CO2, dry chemical. When heated to decomposition it emits acrid smoke and fumes.
[Hazardous Substances Data]

84-69-5(Hazardous Substances Data)
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-Butanol-->Phthalic anhydride-->2-Methyl-1-propanol
Hazard InformationBack Directory
[General Description]

Oily colorless liquid with a slight ester odor. Denser than water. Insoluble in water. Low toxicity.
[Reactivity Profile]

DI-ISOBUTYL PHTHALATE(84-69-5) reacts with acids to liberate heat along with isobutyl alcohol and phthalic acid. May react sufficiently exothermically with strong oxidizing acids to ignite the reaction products. Heat is also generated by interaction with caustic solutions. Flammable hydrogen is generated by mixing with alkali metals and hydrides. Can generate electrostatic charges in handling [Handling Chemicals Safely, 1980. p. 250].
[Air & Water Reactions]

Insoluble in water.
[Health Hazard]

Vapors from very hot material may irritate eyes and produce headache, drowsiness, and convulsions.
[Fire Hazard]

This chemical is combustible.
[Chemical Properties]

clear liquid
[Uses]

Diisobutyl Phthalate is a Dialkyl phthalate ester phthalate plasticizer which can be used as a substitute of dibutyl phthalate. Diisobutyl Phthalate as well as other phthalates have genotoxic effects and studies shown an increase in its monoester metabolite in human urine over the years.
[Definition]

ChEBI: A phthalate ester that is the diester obtained by the formal condensation of the carboxy groups of phthalic acid with two molecules of isobutanol.
[Production Methods]

Diisobutyl phthalate is manufactured by esterifying phthalic anhydride and isobutanol in the presence of sulfuric acid.
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1,2-Benzenedicarboxylic acid bis(2-methylpropyl) ester(84-69-5).msds
Spectrum DetailBack Directory
[Spectrum Detail]

Diisobutyl phthalate(84-69-5)MS
Diisobutyl phthalate(84-69-5)1HNMR
Diisobutyl phthalate(84-69-5)13CNMR
Diisobutyl phthalate(84-69-5)IR1
Diisobutyl phthalate(84-69-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Diisobutyl phthalate, 99+%(84-69-5)
[Alfa Aesar]

Diisobutyl phthalate, 99%(84-69-5)
[Sigma Aldrich]

84-69-5(sigmaaldrich)
[TCI AMERICA]

Diisobutyl Phthalate,>98.0%(GC)(84-69-5)
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