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(2E)-2,3-Bis(acetyloxy)-2-butenedioic Acid 1,4-Dimethyl Ester | 130-84-7

Product name:(2E)-2,3-Bis(acetyloxy)-2-butenedioic Acid 1,4-Dimethyl Ester

CAS No:130-84-7
MF:C10H12O8
MW:260.19748
MDL:MFCD01726213
CID:36253
PubChem ID:13100501
Names and Identifiers
  • Dimethyl diacetoxyfumarate
  • (E)-2,3-Bis(acetyloxy)-2-butenedioic acid dimethyl ester
  • DIMETHYL (Z)-2,3-DIACETYLOXYBUT-2-ENEDIOATE
  • (2E)-2,3-Bis(acetyloxy)-2-butenedioic Acid 1,4-Dimethyl Ester
  • Diacetoxy-fumaric acid dimethyl ester
  • Diacetoxy-fuMaric Acid DiMethyl Ester (DAF)
  • Diacetoxy-fumarsaeure-dimethylester
  • Dihydroxyfumaric acid dimethyl ester diacetate
  • dimethyl 2,3-diacetoxyfumarate
  • Fumaric acid,dihydroxy-,dimethyl ester,diacetate
  • Brn 1715167
  • 1,4-Dimethyl (2E)-2,3-bis(acetyloxy)but-2-enedioate
  • Fumaric acid, dihydroxy-, dimethyl ester, diacetate
  • AS-3253
  • 130-84-7
  • SCHEMBL359791
  • NKGXGEHGPYWBDK-BQYQJAHWSA-N
  • 1,4-dimethyl (2E)-2,3-bis(acetyloxy)but-2-enedioate
  • dimethyl (E)-2,3-diacetyloxybut-2-enedioate
  • 2-Butenedioic acid, 2,3-bis(acetyloxy)-, 1,4-dimethyl ester, (2E)-
  • SCHEMBL359792
  • AKOS037643709
  • ?DIMETHYL (Z)-2,3-DIACETYLOXYBUT-2-ENEDIOATE
  • 1,4-dimethyl(2E)-2,3-bis(acetyloxy)but-2-enedioate
  • (E)-Dimethyl 2,3-diacetoxyfumarate
  • A806155
  • MFCD01726213
  • MDL:MFCD01726213
  • InChIKey:NKGXGEHGPYWBDK-FPLPWBNLSA-N
  • Inchi:InChI=1S/C10H12O8/c1-5(11)17-7(9(13)15-3)8(10(14)16-4)18-6(2)12/h1-4H3/b8-7-
  • SMILES:C(O/C(/C(OC)=O)=C(\OC(=O)C)/C(OC)=O)(=O)C
Chemical and Physical Properties

Computed Properties

  • Exact Mass: 260.05300
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Rotatable Bond Count: 8
  • Monoisotopic Mass: 260.05321734 g/mol
  • Heavy Atom Count: 18
  • Complexity: 368
  • Isotope Atom Count: 0
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Covalently-Bonded Unit Count: 1
  • XLogP3: 0.1
  • Topological Polar Surface Area: 105Ų
  • Molecular Weight: 260.20

Experimental Properties

  • LogP: -0.32980
  • PSA: 105.20000
  • Refractive Index: 1.462
  • Boiling Point: 322.8±42.0 °C at 760 mmHg
  • Melting Point: 102-105 ºC
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C
  • Flash Point: 140.1±27.9 °C
  • Density: 1.296
Security Information
  • Safety Instruction:H303 may be harmful by ingestion +h313 may be harmful by skin contact +h333 may be harmful by inhalation
  • Hazard Statement:H303 may be harmful by ingestion +h313 may be harmful by skin contact +h333 may be harmful by inhalation
  • Warning Statement:P264Thoroughly clean after treatment+P280Wear protective gloves/Wear protective clothing/Wear protective goggles/Wear a protective mask+P305If it enters the eyes+P351Rinse carefully with water for a few minutes+P338Remove the contact lens(If any)And easy to operate,Continue flushing+P337If eye irritation persists+P313Obtain medical advice/care
  • Storage Condition:storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
  • Signal Word:warning
Customs Data
  • HS CODE:2918990090
  • Customs Data:

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

Related Literature
  • 1. 387. Topochemistry. Part V. The crystal structure of 2,5-dimethyl-1,4-benzoquinone D. Rabinovich,G. M. J. Schmidt J. Chem. Soc. 1964 2030
Price Data Available
Brand:a2bchem Supplier:A2B Chem LLC
No. Purity Stock Specification Price update time operate
AA38503-5g >95% 2 weeks 5g $499.00/ ¥3,624.34 04 Jan. 2024
AA38503-1g >95% 2 weeks 1g $264.00/ ¥1,917.48 04 Jan. 2024
AA38503-10mg >95% 2 weeks 10mg $241.00/ ¥1,750.43 04 Jan. 2024
AA38503-5mg >95% 2 weeks 5mg $215.00/ ¥1,561.59 04 Jan. 2024
AA38503-1mg >95% 2 weeks 1mg $202.00/ ¥1,467.17 04 Jan. 2024
Brand:Key Organics Supplier:Key Organics Ltd
No. Purity Stock Specification Price update time operate
AS-3253-5G >95% Same Day Despatch 5g £233.00/ ¥1,941.87 09 Sep. 2023
AS-3253-1G >95% Same Day Despatch 1g £78.00/ ¥650.07 09 Sep. 2023
AS-3253-10MG >95% Same Day Despatch 10mg £63.00/ ¥525.05 09 Sep. 2023
AS-3253-5MG >95% Same Day Despatch 5mg £46.00/ ¥383.37 09 Sep. 2023
AS-3253-1MG >95% Same Day Despatch 1mg £37.00/ ¥308.37 09 Sep. 2023
Brand:trc Supplier:TRC
No. Purity Stock Specification Price update time operate
B400140-10000mg 0.0 10g $ 1533.00/ ¥11,134.49 18 Apr. 2023
B400140-1000mg 0.0 1g $ 196.00/ ¥1,423.59 18 Apr. 2023
B400140-10g 0.0 10g $ 1270.00/ ¥9,224.26 07 Jun. 2022
B400140-1g 0.0 1g $ 160.00/ ¥1,162.11 07 Jun. 2022
Brand:enovation Supplier:eNovation Chemicals LLC
No. Purity Stock Specification Price update time operate
Y0998845-10g 95% 10g $800/ ¥5,810.56 16 May. 2023
Brand:aksc Supplier:AK Scientific
No. Purity Stock Specification Price update time operate
AMTGC200-5g 97% (GC) 5g $463/ ¥3,362.86 16 Sep. 2023
AMTGC200-1g 97% (GC) 1g $155/ ¥1,125.80 16 Sep. 2023
AMTGC200-250mg 97% (GC) 250mg $59/ ¥428.53 16 Sep. 2023
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