Dimethyl fumarate supplier

Name
Dimethyl fumarate
EINECS 210-849-0
CAS No. 624-49-7
Article Data218
CAS DataBase
Density 1.124 g/cm³
Solubility Soluble in water (1.6 mg/ml at 20°C), methanol (30-36 mg/ml), ethanol (10 mg/ml at 25°C), DMSO (29 mg/ml at 25°C), and DMF (~12 mg/ml).
Melting Point 102-106 °C(lit.)
Formula C₆H₈O₄
Boiling Point 193 °C at 760 mmHg
Molecular Weight 144.127
Flash Point 91.1 °C
Transport Information
Appearance fine white crystalline powder
Safety 26-36/37/39
Risk Codes 21-38-41-43-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms 2-Butenedioic acid (E)-, dimethyl ester;Fumaric acid, dimethyl ester (6CI,8CI);(2E)-2-Butenedioic acid dimethyl ester;(E)-But-2-enedioic acid dimethyl ester;AZL-O 211089;Dimethyl (E)-2-butenedioate;Dimethyl(E)-butenedioate;2-Butenedioic acid(2E)-, 1,4-dimethyl ester;Dimethyl trans-ethylenedicarboxylate;NSC 167432;trans-1,2-Ethylenedicarboxylic aciddimethyl ester;trans-Butenedioic acid dimethyl ester;
PSA 52.60000
LogP -0.11140

Synthetic route

: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With 1-hexylimidazolium DL-lactate at 70℃; for 24h; Kinetics; Product distribution; Further Variations:; Reagents; Temperatures;	100%
With N-Bromosuccinimide; 2,2'-azobis(isobutyronitrile) In tetrachloromethane Heating;	100%
With bromine In dichloromethane at 50℃; for 5h; Irradiation;	98%

: 117753-93-2
(P(CH2CH2P(C6H5)2)3)Co(H2)(1+)*PF6(1-) = (P(CH2CH2P(C6H5)2)3)CoH2PF6

: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In tetrahydrofuran	100%

: 67-56-1
methanol

: 110-17-8
(2E)-but-2-enedioic acid

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With sulfuric acid for 8h; Reflux;	99%
With acetyl chloride at 45 - 60℃; for 5.5h; Temperature; Reagent/catalyst;	99.85%
With sulfuric acid at 105℃; for 0.266667h; Temperature;	99%

: 67-56-1
methanol

: 2756-87-8
methyl hydrogen fumarate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With sulfuric acid at 55℃; for 2h;	98.6%
With thionyl chloride at 10 - 65℃;	80 g

: 1634-04-4
tert-butyl methyl ether

: 110-17-8
(2E)-but-2-enedioic acid

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With sulfuric acid Reflux; regioselective reaction;	96%
With perchloric acid for 18h; Reflux;	9.3 g

: 112193-23-4
(4R,5R)-2-methoxy-[1,3]dioxolane-4,5-dicarboxylic acid dimethyl ester

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In acetic anhydride for 4h; Heating;	95%

: dimethyl 2-(p-toluenesulfonamido)-3-(triphenylphosphoranylidene)butanedioate

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 1058-14-6
N-p-tolylsulfonylphosphine imide

C: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In toluene for 14h; Heating;	A n/a B 93% C n/a

...Expand

: 4637-24-5
N,N-dimethyl-formamide dimethyl acetal

: 110-17-8
(2E)-but-2-enedioic acid

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In tetrahydrofuran at 20℃; Reflux;	93%

: (4R,5R)-2,2-Dioxo-2λ6-[1,3,2]dioxathiolane-4,5-dicarboxylic acid dimethyl ester

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With lithium iodide In acetone for 0.166667h; Ambient temperature;	90%
With magnesium iodide In acetonitrile for 0.0833333h; Ambient temperature;	90%
With iodine; triphenylphosphine In dichloromethane for 2h; Ambient temperature; various conditions;	85%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 74-86-2
acetylene

A: 692-91-1, 692-92-2, 1119-43-3, 1733-37-5
cis,cis-dimethyl muconate

B: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

C: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
PdI2-KI at 60℃; under 19000 Torr; for 15h;	A 7% B 89% C 3%

...Expand

: 623-43-8, 4358-59-2, 18707-60-3, 130981-57-6
methyl crotonate

: (3SR,5SR)-1-(benzyloxy)oct-7-ene-3,5-diol

: methyl (5SR,7SR,E)-9-(benzyloxy)-5,7-dihydroxynon-2-enoate

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With tricyclohexylphosphine[1,3-bis(2,4,6-trimethylphenyl)-4,5-dihydroimidazol-2-ylidine][benzylidene]ruthenium(II) dichloride In dichloromethane for 3h; Inert atmosphere; Reflux;	A 89% B n/a

...Expand

: dimethyl meso-tartrate cyclic sulfate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With iodine; triphenylphosphine In dichloromethane Ambient temperature;	86%
With triphenylphosphine In xylene at 110℃;	45%

: 67-56-1
methanol

: 201230-82-2
carbon monoxide

: 74-86-2
acetylene

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With hydrogenchloride; oxygen; copper dichloride; palladium dichloride under 1 Torr; for 2h;	A 86% B 14%

...Expand

: 6832-16-2
methyl diazoacetate

: 55261-56-8
3-morpholino-but-2-enoic acid methyl ester

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 624-49-7
dimethylfumarate

: (1R,2R)-3-Methyl-3-morpholin-4-yl-cyclopropane-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
copper acetylacetonate In ethyl acetate Heating;	A n/a B n/a C 86%

...Expand

: 617-55-0
dimethyl (S)-malate

A: 76003-45-7
dimethyl (2R)-fluorosuccinate

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With diethylamino-sulfur trifluoride In chloroform at 0℃; for 0.5h;	A 85% B 6%

: 132559-56-9
3-<1.2.4>trioxolan-3-ylmethyl-cyclohexanone

: 21204-67-1
methyl (triphenylphosphoranylidene)acetate

A: 132559-62-7
4-(3-oxocyclohexyl)-2(E)-butenoic acid methyl ester

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In dichloromethane at 20℃; for 12h; Wittig type reaction;	A 85% B 3%

...Expand

: 23652-59-7
4-(pyrrolidin-1-yl)pent-3-en-2-one

: 6832-16-2
methyl diazoacetate

A: 85392-47-8
methyl 2-acetyl-4-oxovalerate

B: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

C: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
copper(I) triflate In dichloromethane at 20℃; for 24h;	A 84% B n/a C n/a

...Expand

: 6832-16-2
methyl diazoacetate

: 137201-66-2
E-methyl β-morpholino-cinnamate

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 624-49-7
dimethylfumarate

: (1R,2R)-3-Morpholin-4-yl-3-phenyl-cyclopropane-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
copper acetylacetonate In ethyl acetate Heating;	A n/a B n/a C 84%

...Expand

: 6832-16-2
methyl diazoacetate

: (E)-3-Morpholin-4-yl-3,N-diphenyl-acrylamide

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 624-49-7
dimethylfumarate

: (1R,3R)-2-Morpholin-4-yl-2-phenyl-3-phenylcarbamoyl-cyclopropanecarboxylic acid methyl ester

Conditions

Conditions	Yield
copper acetylacetonate In ethyl acetate Heating;	A n/a B n/a C 83%

...Expand

: 608-68-4, 608-69-5, 5057-96-5, 13171-64-7, 117356-23-7
dimethyl L-tartrate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With 1H-imidazole; iodine; chloro-diphenylphosphine In toluene; acetonitrile Ambient temperature;	81%

: 21204-67-1
methyl (triphenylphosphoranylidene)acetate

A: 3878-44-2
Triphenylphosphine selenide

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With selenium In toluene for 3h; Heating;	A 77.6% B 73.6%

: 762-42-5
dimethyl acetylenedicarboxylate

A: 89330-93-8
dimethyl phenylmaleate

B: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

C: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With cyclopentadienylchromiumtricarbonyl hydride In benzene Inert atmosphere;	A 76% B 17% C 5%

...Expand

: 21204-67-1
methyl (triphenylphosphoranylidene)acetate

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
With selenium In toluene for 4h; Heating;	74%

: 616-42-2
dimethylsulfite

: 110-17-8
(2E)-but-2-enedioic acid

: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
sulfuric acid In methanol Heating;	73%

: 70008-80-9
3-morpholin-4-yl-1-phenyl-but-2-en-1-one

: 6832-16-2
methyl diazoacetate

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 75519-84-5
3-oxo-2-(2-oxo-2-phenyl-ethyl)-butyric acid methyl ester

C: 624-49-7
dimethylfumarate

D: 3-Methyl-5-phenyl-furan-2-carboxylic acid methyl ester

Conditions

Conditions	Yield
copper(I) triflate In dichloromethane at 20℃;	A n/a B 73% C n/a D 4%

...Expand

: 489-84-9
7-isopropyl-1,4-dimethyl-azulene

: 762-42-5
dimethyl acetylenedicarboxylate

A: 98525-07-6, 72898-39-6, 98525-12-3, 98525-13-4
dimethyl 1,6-dimethyl-9-(1-methylethyl)heptalene-4,5-dicarboxylate

B: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

C: 145948-88-5
dimethyl (E)-1-(5'-isopropyl-3',8'-dimethylazulen-1-yl)-ethene-1,2-dicarboxylate

D: 145948-89-6
dimethyl (Z)-1-(5-isopropyl-3,8-dimethylazulen-1-yl)ethene-1,2-dicarboxylate

E: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In acetonitrile at 100℃; for 4h; Mechanism; other solvents, other substrates;	A 71% B 1% C 15% D 11% E 1%

...Expand

: 489-84-9
7-isopropyl-1,4-dimethyl-azulene

: 762-42-5
dimethyl acetylenedicarboxylate

A: 98525-07-6, 72898-39-6, 98525-12-3, 98525-13-4
dimethyl 1,6-dimethyl-9-(1-methylethyl)heptalene-4,5-dicarboxylate

B: 145948-88-5
dimethyl (E)-1-(5'-isopropyl-3',8'-dimethylazulen-1-yl)-ethene-1,2-dicarboxylate

C: 145948-89-6
dimethyl (Z)-1-(5-isopropyl-3,8-dimethylazulen-1-yl)ethene-1,2-dicarboxylate

D: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
In acetonitrile at 100℃; for 4h; Further byproducts given;	A 71% B 15% C 11% D 1%

...Expand

: 67-56-1
methanol

: 110-17-8
(2E)-but-2-enedioic acid

A: 2756-87-8
methyl hydrogen fumarate

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
sulfuric acid at 60 - 70℃; for 3h; Product distribution / selectivity; Industry scale;	A n/a B 71%

...Expand

: 67866-50-6
diethyl (2-bromo-1-phenylvinyl)phosphonite

: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

A: 1-ethoxy-2-phenyl-4,5-dimethoxycarbonyl-Δ2-λ5-phospholene 1-oxide

B: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
for 4h; Ambient temperature;	A 27% B 70%

...Expand

: 70008-81-0
(E)-3-morpholin-4-yl-1,3-diphenylpropenone

: 6832-16-2
methyl diazoacetate

A: 624-48-6
dimethyl cis-but-2-ene-1,4-dioate

B: 90904-37-3
methyl α,β-dibenzoyl-propionate

C: 624-49-7
dimethylfumarate

Conditions

Conditions	Yield
copper(I) triflate In dichloromethane at 20℃;	A n/a B 70% C n/a

...Expand

: 50-00-0
formaldehyd

: 17136-36-6
N-benzylglycine

: 624-49-7
dimethylfumarate

: 87813-05-6, 87813-06-7, 111186-67-5
dimethyl (3R,4R)-1-benzylpyrrolidine-3,4-dicarboxylate

Conditions

Conditions	Yield
In toluene for 0.25h; Heating;	100%
In benzene for 3h; Heating;	63%
In toluene

...Expand

: 109-69-3
n-Butyl chloride

: 90606-10-3
(E)-N-(phenylmethylene)-1-(trimethylsilyl)methylamine

: 624-49-7
dimethylfumarate

: 82959-82-8, 82959-83-9, 82959-84-0, 82959-85-1
(3R,4R)-2-Phenyl-pyrrolidine-3,4-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
In N,N,N,N,N,N-hexamethylphosphoric triamide at 40 - 45℃;	100%

...Expand

: 57402-97-8
N-<(trimethylsilyl)methyl>benzaldimine

: 624-49-7
dimethylfumarate

: 82959-82-8, 82959-83-9, 82959-84-0, 82959-85-1
(3R,4S)-2-Phenyl-pyrrolidine-3,4-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With water; acetic acid In N,N,N,N,N,N-hexamethylphosphoric triamide for 24h; Ambient temperature;	100%

: 61201-25-0
3-methylene-2-phenyl-4-penten-2-ol

: 624-49-7
dimethylfumarate

: (1S,2S)-4-(1-Hydroxy-1-phenyl-ethyl)-cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
In benzene for 16h; Heating;	100%

: 40448-79-1
isoquinolinium phenylacylide

: 624-49-7
dimethylfumarate

: 97204-11-0, 97275-44-0, 105017-20-7
(1R,2R,3R,10bR)-3-Benzoyl-1,2,3,10b-tetrahydro-pyrrolo[2,1-a]isoquinoline-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
In chloroform for 0.166667h; Ambient temperature;	100%

: 33059-38-0
5H-cyclopropisobenzofuran

: 624-49-7
dimethylfumarate

: 113605-10-0
C15H14O5

Conditions

Conditions	Yield
In cyclohexane at 25℃; Rate constant;	100%
In tetrahydrofuran at -30℃; for 0.0833333h;	100%

: Benzoic acid 4-methoxythiocarbonylsulfanyl-but-2-ynyl ester

: 624-49-7
dimethylfumarate

: (5S,6S)-2-Oxo-4,5,6,7-tetrahydro-benzo[1,3]dithiole-5,6-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
In chlorobenzene Heating;	100%

: 100281-17-2
2-(4-methoxyphenyl)-3-methylenepent-4-en-2-ol

: 624-49-7
dimethylfumarate

: (1S,2S)-4-[1-Hydroxy-1-(4-methoxy-phenyl)-ethyl]-cyclohex-4-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
In benzene for 10h; Heating;	100%

: 1-(2-oxo-2-phenylethyl)pyridazin-1-ium bromide

: 624-49-7
dimethylfumarate

: (4aS,5R,6R,7R)-7-Benzoyl-4a,5,6,7-tetrahydro-pyrrolo[1,2-b]pyridazine-5,6-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With triethylamine In chloroform for 0.166667h; Ambient temperature;	100%

: 23134-50-1
1H-2-naphtho<2,1-b>thiete

: 624-49-7
dimethylfumarate

: trans-2,3-Dihydro-1H-naphtho<2,1-b>thiopyran-2,3-dicarbonsaeure-dimethylester

Conditions

Conditions	Yield
In toluene at 80 - 110℃;	100%
at 80 - 110℃; Yield given;

: 162889-67-0
(diisopropoxyphosphinoyl)formonitriole oxide

: 624-49-7
dimethylfumarate

: 3-(diisopropoxyphosphinoyl)-4,5-trans-bis(methoxycarbonyl)isoxazoline

Conditions

Conditions	Yield
In dichloromethane at -78℃;	100%

: 174006-54-3
2H-naphtho<1,2-b>thiete

: 624-49-7
dimethylfumarate

: trans-3,4-Dihydro-2H-naphtho<1,2-b>thiopyran-2,3-dicarbonsaeure-dimethylester

Conditions

Conditions	Yield
In toluene at 80 - 110℃;	100%
In toluene Heating;	100%

: 177028-67-0
2-oxo-4H-3,1-naptho<1,2-d>oxathiin

: 624-49-7
dimethylfumarate

: trans-3,4-Dihydro-2H-naphtho<1,2-b>thiopyran-2,3-dicarbonsaeure-dimethylester

Conditions

Conditions	Yield
In toluene for 16h; Heating;	100%

: 41078-15-3
3-aminothieno<3,4:3',4'>benzopyran-4-one

: 624-49-7
dimethylfumarate

: dimethyl 4-aminobenzocoumarin-2,3-dicarboxylate

Conditions

Conditions	Yield
Heating;	100%
at 170℃; for 4h;	76%

: 75-30-9
2-iodo-propane

: 17851-98-8
1-phenyl-1-(tributylstannyloxy)ethene

: 624-49-7
dimethylfumarate

: dimethyl 2-isopropyl-3-phenacylbutanedioate

Conditions

Conditions	Yield
With 2,2'-azobis(isobutyronitrile) In benzene at 80℃; for 4h;	100%

...Expand

: 20433-10-7
5-(4-methoxyphenyl)-2-phenyl-2H-tetrazole

: 624-49-7
dimethylfumarate

: (4RS,5SR)-dimethyl 3-(4-methoxyphenyl)-1-phenyl-4,5-dihydro-1H-pyrazole-4,5-dicarboxylate

Conditions

Conditions	Yield
In ethyl acetate for 2h; UV-irradiation;	100%

: 75-31-0
isopropylamine

: 624-49-7
dimethylfumarate

: 17459-45-9
dimethyl 2-(iso-propylamino)succinate

Conditions

Conditions	Yield
In acetonitrile at 0 - 20℃; for 16h;	100%

: 159665-98-2
Cr(CO)3(C9(CH3)7)Rh(CO)2

: 624-49-7
dimethylfumarate

: trans-[Cr(CO)3(heptamethylindenyl)Rh(CO)(fumaric acid dimethyl ester)]

Conditions

Conditions	Yield
In dichloromethane Ar-atmosphere; 35°C (1 h); evapn. (Ar-stream), washing (pentane); elem. anal.;	100%

: (platinum)(hydride)(bromide)(1,3-bis(2,4,6-trimethylphenyl)imidazolin-2-ylidene)(1,2-dimethyl-3-propylimidazole)

: (platinum)(hydride)(bromide)(1,3-bis(2,4,6-trimethylphenyl)imidazolin-2-ylidene)(1,2-dimethyl-3-propylimidazole)

: 624-49-7
dimethylfumarate

: (1,3-dimesitylimidazol-2-ylidene)platinum(0) bis(η2-dimethylfumarate)

Conditions

Conditions	Yield
In acetone byproducts: C3H2N2(CH3)2(C3H7)Br; reductive elimination for 3 h;	100%

...Expand

: (3S,4S)-3-((E)-Buta-1,3-dienyl)-4-(4-chloro-phenyl)-1-cyclohexyl-azetidin-2-one

: 624-49-7
dimethylfumarate

: 3-[2-(4-chlorophenyl)-1-cyclohexyl-4-oxoazetidin-3-yl]cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: C19H16ClNO

: 624-49-7
dimethylfumarate

: 3-[2-(4-chlorophenyl)-4-oxo-1-phenylazetidin-3-yl]cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: (3R,4S)-3-((E)-Buta-1,3-dienyl)-1,4-diphenyl-azetidin-2-one

: 624-49-7
dimethylfumarate

: 3-(2-oxo-1,4-diphenylazetidin-3-yl)cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: trans-3-(1,3-butadienyl)-1-phenyl-(4-methoxyphenyl)azetidin-2-one

: 624-49-7
dimethylfumarate

: 3-[2-(4-methoxyphenyl)-4-oxo-1-phenylazetidin-3-yl]cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: 624-49-7
dimethylfumarate

: cis-3-(1',3'-butadienyl)-1-cyclohexyl-4-phenylazetidin-2-one

: 3-(1-cyclohexyl-2-oxo-4-phenylazetidin-3-yl)cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: 624-49-7
dimethylfumarate

: cis-3-(1',3'-butadienyl)-1-cyclohexyl-4-(p-methoxyphenyl)azetidin-2-one

: 3-[1-cyclohexyl-2-(4-methoxyphenyl)-4-oxoazetidin-3-yl]cyclohex-3-ene-1,2-dicarboxylic acid dimethyl ester

Conditions

Conditions	Yield
With titanium tetrachloride In dichloromethane at -78℃; Diels-Alder reaction;	100%

: 542-92-7
cyclopenta-1,3-diene

: 624-49-7
dimethylfumarate

: dimethyl norborn-5-ene-2,3-endo-dicarboxylate

Conditions

Conditions	Yield
at 20℃; for 8h; Diels-Alder cycloaddition;	100%

: 12078-25-0
dicarbonylcyclopentadienylcobalt

: 624-49-7
dimethylfumarate

: [(η5-C5H5)Co(CO)(dimethyl fumarate)]

Conditions

Conditions	Yield
In toluene Irradiation (UV/VIS); reflux, 3 h; flash chromy. on silica gel;	100%
In toluene for 3h; Reflux; Irradiation;

: 189559-57-7
1,2-bis(diphenylphosphino)ethane hydridoplatinum molybdenum cyclopentadiene (CO)3

: 624-49-7
dimethylfumarate

A: 12176-06-6
hydrido(tricarbonyl)(cyclopentadienyl)molybdenum

B: C32H32O4P2Pt

Conditions

Conditions	Yield
In benzene-d6 at 30℃; for 0.25h; Inert atmosphere; Schlenk technique;	A 100% B 74%

...Expand

Dimethyl fumarate Chemical Properties

Molecule structure of Dimethyl fumarate (CAS NO.624-49-7):

IUPAC Name: Dimethyl (E)-but-2-enedioate
Molecular Weight: 144.12532 g/mol
Molecular Formula: C₆H₈O₄
Density: 1.124 g/cm³
Melting Point: 102-106 °C(lit.)
Boiling Point: 193 °C at 760 mmHg
Flash Point: 91.1 °C
Index of Refraction: 1.435
Molar Refractivity: 33.45 cm³
Molar Volume: 128.1 cm³
Surface Tension: 33.1 dyne/cm
Enthalpy of Vaporization: 42.92 kJ/mol
Vapour Pressure: 0.475 mmHg at 25 °C
Storage Temp. store at RT.
Stability: stable. incompatible with acids, bases, oxidizing agents, reducing agents.
XLogP3: 0.7
H-Bond Acceptor: 4
Rotatable Bond Count: 4
Exact Mass: 144.042259
MonoIsotopic Mass: 144.042259
Topological Polar Surface Area: 52.6
Heavy Atom Count: 10
Canonical SMILES: COC(=O)C=CC(=O)OC
Isomeric SMILES: COC(=O)/C=C/C(=O)OC
InChI: InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+
InChIKey: LDCRTTXIJACKKU-ONEGZZNKSA-N
EINECS: 210-849-0
Product Categories: Acids & Esters; C6 to C7; Carbonyl Compounds; Esters

Dimethyl fumarate Uses

Dimethyl fumarate (CAS NO.624-49-7) is widely used in food, feed, tobacco, leather or other anticorrosion ,mouldproof and preservation. Dimethyl fumarate is used to treat psoriasis. It is a lipophilic, highly mobile molecule in human tissue. Another use for dimethyl fumarate is mold inhibition, mostly for leather products.

Dimethyl fumarate Toxicity Data With Reference

1.	skn-rbt 20 mg/24H MOD	85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,373.
2.	eye-rbt 250 µg/24H SEV	85JCAE Prehled Prumyslove Toxikologie; Organicke Latky Marhold, J.,Prague, Czechoslovakia.: Avicenum,1986,373.
3.	orl-rat LD50:2240 mg/kg	AIHAAP American Industrial Hygiene Association Journal. 30 (1969),470.
4.	skn-rbt LD50:1250 mg/kg	AIHAAP American Industrial Hygiene Association Journal. 30 (1969),470.

Dimethyl fumarate Consensus Reports

Reported in EPA TSCA Inventory.

Dimethyl fumarate Safety Profile

Hazard Codes: Harmful Xn
Risk Statements: 21-38-41-43-36/37/38
R21:Harmful in contact with skin.
R38:Irritating to skin.
R41:Risk of serious damage to the eyes.
R43:May cause sensitization by skin contact.
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection.
WGK Germany: 1
RTECS: EM6125000
HS Code: 29171990
Moderately toxic by ingestion and skin contact. A skin and severe eye irritant. When heated to decomposition it emits acrid smoke and irritating fumes. See also ESTERS.

Dimethyl fumarate Specification

Dimethyl fumarate (CAS NO.624-49-7) is also named as 2-Butenedioic acid, dimethyl ester, (E)- ; 4-02-00-02205 (Beilstein Handbook Reference) ; AI3-07872 ; Allomaleic acid dimethyl ester ; BG 00012 ; BG 12 compound ; BG-00012 ; BG00012 ; BRN 0774590 ; Boletic acid dimethyl ester ; Dimethyl trans-ethylenedicarboxylate ; Dimethylester kyseliny fumarove ; Dimethylester kyseliny fumarove [Czech] ; Dimethylfumarate ; Ethylene, 1,2-bis(methoxycarbonyl)-, trans- ; FAG 201 ; FAG201 ; Fumaderm ; Fumaric acid, dimethyl ester ; Methyl fumarate ; NSC 167432 ; NSC 25942 ; TL 353 ; UNII-FO2303MNI2 ; trans-1,2-Ethylenedicarboxylic acid dimethyl ester ; trans-Butenedioic acid dimethyl ester . Dimethyl fumarate (CAS NO.624-49-7) is fine white crystalline powder.

Product Name

Dimethyl fumarate

Synthetic route

Dimethyl fumarate Chemical Properties

Dimethyl fumarate Uses

Dimethyl fumarate Toxicity Data With Reference

Dimethyl fumarate Consensus Reports

Dimethyl fumarate Safety Profile

Dimethyl fumarate Specification

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