ChemicalBook--->CAS DataBase List--->105-76-0

105-76-0

105-76-0 Structure

105-76-0 Structure
IdentificationMore
[Name]

Dibutyl maleate
[CAS]

105-76-0
[Synonyms]

2-BUTENEDIOIC ACID (Z)-,DIBUTYL ESTER
BUTYL MALEATE
DBM
DIBUTYL MALEATE
DI-N-BUTYL MALEATE
MALEIC ACID DIBUTYL ESTER
MALEIC ACID DI-N-BUTYL ESTER
(Z)-2-Butenedioic acid dibutyl ester
2-Butenedioic acid, dibutyl ester
2-butenedioicacid,dibutylester
Bibutyl maleate
Bisomer DBM
dibutyl
Dibutyl (2Z)-2-butenedioate
Dibutylester kyseliny maleinove
dibutylesterkyselinymaleinove
Dibutylmaeate
Octomer DBM
PX-504
RC Comonomer DBM
[EINECS(EC#)]

203-328-4
[Molecular Formula]

C12H20O4
[MDL Number]

MFCD00009447
[Molecular Weight]

228.28
[MOL File]

105-76-0.mol
Chemical PropertiesBack Directory
[Appearance]

CLEAR COLOURLESS TO SLIGHTLY YELLOWISH LIQUID
[Melting point ]

-85°C
[Boiling point ]

281 °C(lit.)
[density ]

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

-85
[vapor pressure ]

0.0027 hPa (20 °C)
[refractive index ]

n20/D 1.445(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

0.17g/l slightly soluble
[form ]

Liquid
[color ]

Clear colorless to light yellow
[explosive limit]

0.5-3.4%(V)
[Water Solubility ]

insoluble
[FreezingPoint ]

<-85℃
[Detection Methods]

GC
[BRN ]

1726634
[Henry's Law Constant]

2.6×101 mol/(m3Pa) at 25℃, Duchowicz et al. (2020)
[Cosmetics Ingredients Functions]

PERFUMING
[InChI]

1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3/b8-7-
[InChIKey]

JBSLOWBPDRZSMB-FPLPWBNLSA-N
[SMILES]

[H]\C(=C(/[H])C(=O)OCCCC)C(=O)OCCCC
[LogP]

3.39 at 25℃
[CAS DataBase Reference]

105-76-0(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Butenedioic acid (Z)-, dibutyl ester(105-76-0)
[EPA Substance Registry System]

105-76-0(EPA Substance)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Health Hazard (GHS08)Environment (GHS09)
GHS07,GHS08,GHS09
[Signal word ]

Warning
[Hazard statements ]

H317-H373-H411
[Precautionary statements ]

P260-P272-P273-P280-P302+P352-P314
[Hazard Codes ]

Xi,N
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R51/53:Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
S37:Wear suitable gloves .
S29:Do not empty into drains .
S24:Avoid contact with skin .
[WGK Germany ]

1
[RTECS ]

ON0875000
[Autoignition Temperature]

280 °C
[TSCA ]

Yes
[REACH Registrations]

Active
[HS Code ]

29171990
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Aquatic Chronic 2
Skin Sens. 1
STOT RE 2 Oral
[Safety Profile]

Poison by intraperitoneal route. Moderately toxic by ingestion. Mddly toxic by skin contact. An eye and skin irritant. See also ESTERS and n-BUTYL ALCOHOL. Combustible when exposed to heat or flame; can react with oxilzing materials. To fight fire, use foam, CO2, dry chemical, alcohol foam. When heated to decomposition it emits acrid smoke and irritating fumes.
[Toxicity]

LD50 orally in Rabbit: > 2000 mg/kg LD50 dermal Rabbit 10039 mg/kg
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-Butanol-->Maleic anhydride-->2-Ethylhexanol-->Maleic acid-->1-Nonanol-->Dibutylmalate-->Butanedioic acid, 2,3-dihydroxy-, 1,4-dibutyl ester-->dibutyl 2,2'-trithiodiacetate-->Tributyl citrate-->Mesotartaric acid-->Dibutyl fumarate-->Monobutyl maleate-->Dibutyl oxalate-->Butyl formate-->Dibutyl succinate-->1-Pentanol-->Butyl acrylate-->carbon monoxide
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Dibutyl maleate(105-76-0).msds
Hazard InformationBack Directory
[Chemical Properties]

CLEAR COLOURLESS TO SLIGHTLY YELLOWISH LIQUID
[Uses]

Dibutyl maleate is used as a copolymer and plasticizer.
[Preparation]

By direct esterification of n-Butanol with Maleic acid.
Spectrum DetailBack Directory
[Spectrum Detail]

Dibutyl maleate(105-76-0)MS
Dibutyl maleate(105-76-0)1HNMR
Dibutyl maleate(105-76-0)13CNMR
Dibutyl maleate(105-76-0)IR1
Dibutyl maleate(105-76-0)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Dibutyl maleate, 99%(105-76-0)
[Sigma Aldrich]

105-76-0(sigmaaldrich)
[TCI AMERICA]

Dibutyl Maleate,>95.0%(GC)(105-76-0)
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