13545-04-5,MFCD00002657
Catalog No.:AA009AMZ

13545-04-5 | 2,3-Dimethylsuccinic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$162.00   $114.00
- +
5g
95%
in stock  
$615.00 $430.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA009AMZ
Chemical Name:
2,3-Dimethylsuccinic acid
CAS Number:
13545-04-5
Molecular Formula:
C6H10O4
Molecular Weight:
146.1412
MDL Number:
MFCD00002657
SMILES:
CC(C(C)C(=O)O)C(=O)O
Properties
Computed Properties
 
Complexity:
134  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.4  

Downstream Synthesis Route

[1]Barbarella,G.;Dembech,P.[OrganicMagneticResonance,1980,vol.13,#4,p.282-286]

[2]Kuhn,L.P.etal.[JournaloftheAmericanChemicalSociety,1964,vol.86,p.650-658]

[3]Diversi,Pietro;Ingrosso,Giovanni;Lucherini,Antonio;Porzio,William;Zocchi,Marcello[JournaloftheChemicalSociety,DaltonTransactions,1983,p.967-974]

[4]Pea-Lpez,Miguel;Neumann,Helfried;Beller,Matthias[ChemCatChem,2015,vol.7,#5,p.865-871]

[1]Block;Bayer[JournaloftheAmericanChemicalSociety,1990,vol.112,#11,p.4584-4585]

[1]Erne,Daniel;Ammann,Daniel;Zhukov,AlexF.;Behm,Felix;Pretsch,Ernoe;Simon,Wilhelm[HelveticaChimicaActa,1982,vol.65,p.538-545]

[2]Kates,MichaelJ.;Schauble,J.Herman[JournalofHeterocyclicChemistry,1995,vol.32,#3,p.971-978]

[3]Blizzard,TimothyA.;Dininno,Frank;MorganII,JerryD.;Chen,HelenY.;Wu,JaneY.;Kim,Seongkon;Chan,Wanda;Birzin,ElizabethT.;Yang,YiTien;Pai,Lee-Yuh;Fitzgerald,PaulaM.D.;Sharma,Nandini;Li,Ying;Zhang,Zhoupeng;Hayes,EdwardC.;Dasilva,CarolynA.;Tang,Wei;Rohrer,SusanP.;Schaeffer,JamesM.;Hammond,MiltonL.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#1,p.107-113]

[4]IvyCarroll;Ma,Wei;Navarro,HernanA.;Abraham,Philip;Wolckenhauer,ScottA.;Damaj;Martin,BillyR.[BioorganicandMedicinalChemistry,2007,vol.15,#2,p.678-685]

[5]VanderMey;Hatzelmann;VanderLaan;Sterk;Thibaut;Timmerman[JournalofMedicinalChemistry,2001,vol.44,#16,p.2511-2522]

[6]CurrentPatentAssignee:DUPONTDENEMOURSINC-US6362346,2002,B1Locationinpatent:Example11

[7]CurrentPatentAssignee:MERCK&COINC-WO2003/91239,2003,A1Locationinpatent:Page/Pagecolumn95

[1]Kpegba,Kafui;Metzner,Patrick;Rakotonirina,Rose[TetrahedronLetters,1986,vol.27,#13,p.1505-1508]

[1]Block;Bayer[JournaloftheAmericanChemicalSociety,1990,vol.112,#11,p.4584-4585]

Literature

Title: Isomer-directed structural diversity and its effect on the nanosheet exfoliation and magnetic properties of 2,3-dimethylsuccinate hybrid frameworks.

Journal: Inorganic chemistry 20121015

Title: Diglycolic acid is the nephrotoxic metabolite in diethylene glycol poisoning inducing necrosis in human proximal tubule cells in vitro.

Journal: Toxicological sciences : an official journal of the Society of Toxicology 20111101

Title: Functional characterization of high-affinity Na(+)/dicarboxylate cotransporter found in Xenopus laevis kidney and heart.

Journal: American journal of physiology. Cell physiology 20051101

Title: Substrate specificity of the human renal sodium dicarboxylate cotransporter, hNaDC-3, under voltage-clamp conditions.

Journal: American journal of physiology. Renal physiology 20050401

Title: The renal Na(+)-dependent dicarboxylate transporter, NaDC-3, translocates dimethyl- and disulfhydryl-compounds and contributes to renal heavy metal detoxification.

Journal: Journal of the American Society of Nephrology : JASN 20021101

Quotation Request
Company Name:
*
Contact Person:
*
Email:
*
Quantity Required:
*
Country:
Additional Info:
SDS
Tags:13545-04-5 Molecular Formula|13545-04-5 MDL|13545-04-5 SMILES|13545-04-5 2,3-Dimethylsuccinic acid
Catalog No.: AA009AMZ
13545-04-5,MFCD00002657
13545-04-5 | 2,3-Dimethylsuccinic acid
Pack Size: 1g
Purity: 95%
in stock
$162.00 $114.00
Pack Size: 5g
Purity: 95%
in stock
$615.00 $430.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA009AMZ
Chemical Name: 2,3-Dimethylsuccinic acid
CAS Number: 13545-04-5
Molecular Formula: C6H10O4
Molecular Weight: 146.1412
MDL Number: MFCD00002657
SMILES: CC(C(C)C(=O)O)C(=O)O
Properties
Complexity: 134  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 2  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.4  
Downstream Synthesis Route
13545-04-5    57716-80-0 

[1]Barbarella,G.;Dembech,P.[OrganicMagneticResonance,1980,vol.13,#4,p.282-286]

[2]Kuhn,L.P.etal.[JournaloftheAmericanChemicalSociety,1964,vol.86,p.650-658]

[3]Diversi,Pietro;Ingrosso,Giovanni;Lucherini,Antonio;Porzio,William;Zocchi,Marcello[JournaloftheChemicalSociety,DaltonTransactions,1983,p.967-974]

[4]Pea-Lpez,Miguel;Neumann,Helfried;Beller,Matthias[ChemCatChem,2015,vol.7,#5,p.865-871]

67-56-1    13545-04-5    28306-68-5 

[1]Block;Bayer[JournaloftheAmericanChemicalSociety,1990,vol.112,#11,p.4584-4585]

13545-04-5    7475-92-5 

[1]Erne,Daniel;Ammann,Daniel;Zhukov,AlexF.;Behm,Felix;Pretsch,Ernoe;Simon,Wilhelm[HelveticaChimicaActa,1982,vol.65,p.538-545]

[2]Kates,MichaelJ.;Schauble,J.Herman[JournalofHeterocyclicChemistry,1995,vol.32,#3,p.971-978]

[3]Blizzard,TimothyA.;Dininno,Frank;MorganII,JerryD.;Chen,HelenY.;Wu,JaneY.;Kim,Seongkon;Chan,Wanda;Birzin,ElizabethT.;Yang,YiTien;Pai,Lee-Yuh;Fitzgerald,PaulaM.D.;Sharma,Nandini;Li,Ying;Zhang,Zhoupeng;Hayes,EdwardC.;Dasilva,CarolynA.;Tang,Wei;Rohrer,SusanP.;Schaeffer,JamesM.;Hammond,MiltonL.[BioorganicandMedicinalChemistryLetters,2005,vol.15,#1,p.107-113]

[4]IvyCarroll;Ma,Wei;Navarro,HernanA.;Abraham,Philip;Wolckenhauer,ScottA.;Damaj;Martin,BillyR.[BioorganicandMedicinalChemistry,2007,vol.15,#2,p.678-685]

[5]VanderMey;Hatzelmann;VanderLaan;Sterk;Thibaut;Timmerman[JournalofMedicinalChemistry,2001,vol.44,#16,p.2511-2522]

[6]CurrentPatentAssignee:DUPONTDENEMOURSINC-US6362346,2002,B1Locationinpatent:Example11

[7]CurrentPatentAssignee:MERCK&COINC-WO2003/91239,2003,A1Locationinpatent:Page/Pagecolumn95

57716-80-0    13545-04-5 

[1]Kpegba,Kafui;Metzner,Patrick;Rakotonirina,Rose[TetrahedronLetters,1986,vol.27,#13,p.1505-1508]

127793-93-5    13545-04-5 

[1]Block;Bayer[JournaloftheAmericanChemicalSociety,1990,vol.112,#11,p.4584-4585]

Literature fold

Title: Isomer-directed structural diversity and its effect on the nanosheet exfoliation and magnetic properties of 2,3-dimethylsuccinate hybrid frameworks.

Journal: Inorganic chemistry20121015

Title: Diglycolic acid is the nephrotoxic metabolite in diethylene glycol poisoning inducing necrosis in human proximal tubule cells in vitro.

Journal: Toxicological sciences : an official journal of the Society of Toxicology20111101

Title: Functional characterization of high-affinity Na(+)/dicarboxylate cotransporter found in Xenopus laevis kidney and heart.

Journal: American journal of physiology. Cell physiology20051101

Title: Substrate specificity of the human renal sodium dicarboxylate cotransporter, hNaDC-3, under voltage-clamp conditions.

Journal: American journal of physiology. Renal physiology20050401

Title: The renal Na(+)-dependent dicarboxylate transporter, NaDC-3, translocates dimethyl- and disulfhydryl-compounds and contributes to renal heavy metal detoxification.

Journal: Journal of the American Society of Nephrology : JASN20021101

Building Blocks More >
127684-08-6
127684-08-6
7-KETOCHOLESTEROL-25,26,26,26,27,27,27-D7
AA009B0A | MFCD06658677
130339-07-0
130339-07-0
DIFLUMETORIM
AA009B5A | MFCD03427396
1298023-69-4
1298023-69-4
CAY10654
AA009BKJ
1229-04-5
1229-04-5
protodrol,17a-Methyl-5a-androst-17b-ol
AA009BN9
1433-11-0
1433-11-0
UREA-D4
AA009BSV | MFCD00044227
132336-30-2
132336-30-2
2(1H)-PyriMidinone, 4-aMino-1-[(2S)-2-hydroxy-3-(triphenylMethoxy)propyl]-
AA009C45 | MFCD28167854
1373615-35-0
1373615-35-0
PF-5274857
AA009CBE | MFCD22420827
1402837-79-9
1402837-79-9
Ido-in-5
AA009CFK | MFCD29472255
1316755-16-4
1316755-16-4
PD-126055 free acid
AA009CJM | MFCD28502251
1251006-73-1
1251006-73-1
tert-Butyl 3-(piperidin-3-yl)azetidine-1-carboxylate
AA009CW3 | MFCD14581438
Submit
© 2017 AA BLOCKS, INC. All rights reserved.