Home Other Building Blocks Dimethylmalonic acid

Dimethylmalonic acid

CAS No.:
595-46-0
Catalog Number:
AG0034RK
Molecular Formula:
C5H8O4
Molecular Weight:
132.1146
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
95%
In Stock USA
United States
$9
- +
10g
95%
In Stock USA
United States
$17
- +
100g
98%
In Stock USA
United States
$118
- +
500g
98%
In Stock USA
United States
$400
- +
Product Description
Catalog Number:
AG0034RK
Chemical Name:
Dimethylmalonic acid
CAS Number:
595-46-0
Molecular Formula:
C5H8O4
Molecular Weight:
132.1146
MDL Number:
MFCD00004193
IUPAC Name:
2,2-dimethylpropanedioic acid
InChI:
InChI=1S/C5H8O4/c1-5(2,3(6)7)4(8)9/h1-2H3,(H,6,7)(H,8,9)
InChI Key:
OREAFAJWWJHCOT-UHFFFAOYSA-N
SMILES:
OC(=O)C(C(=O)O)(C)C
EC Number:
209-867-1
UNII:
55981WKX6B
NSC Number:
836
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
132.042g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
132.115g/mol
Monoisotopic Mass:
132.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4  
Literature
Title Journal
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Chiral ionic liquid/ESI-MS methodology as an efficient tool for the study of transformations of supported organocatalysts: deactivation pathways of Jørgensen-Hayashi-type catalysts in asymmetric Michael reactions. Chemistry (Weinheim an der Bergstrasse, Germany) 20110523
Poly[[aqua-μ(3)-2,2-dimethylmalonato-copper(II)] monohydrate] and poly[aqua-μ(3)-2,2-dimethylmalonato-copper(II)]. Acta crystallographica. Section C, Crystal structure communications 20101201
Poly[diaquabis(mu3-2,2-dimethylpropanedioato)calcium(II)copper(II)]. Acta crystallographica. Section C, Crystal structure communications 20100701
Poly[[diaqua(mu3-2,2-dimethylmalonato)cadmium(II)] tetrahydrate]. Acta crystallographica. Section C, Crystal structure communications 20090701
Poly[[aqua(micro-2,2-dimethylmalonato)barium(II)] 2,2-dimethylmalonic acid solvate]. Acta crystallographica. Section C, Crystal structure communications 20081201
catena-Poly[[[(dimethyl-malonato-κO:O')(perchlorato-κO)copper(II)]-μ-bis-(3-pyridylmeth-yl)piperazinediium-κN:N] perchlorate dihydrate]. Acta crystallographica. Section E, Structure reports online 20081201
Bis(dimethyl-malonato-κO,O')bis-[4-(4-pyridylamino-κN)pyridinium]nickel(II) hexa-hydrate. Acta crystallographica. Section E, Structure reports online 20081201
Origin of enantioselectivity in palladium-catalyzed asymmetric allylic alkylation reactions using chiral N,N-ligands with different rigidity and flexibility. Dalton transactions (Cambridge, England : 2003) 20070421
Replacement of chlorides with dicarboxylate ligands in anticancer active Ru(II)-DMSO compounds: a new strategy that might lead to improved activity. Inorganic chemistry 20070205
Electronic differentiation competes with transition state sensitivity in palladium-catalyzed allylic substitutions. Beilstein journal of organic chemistry 20070101
A superior P-H phosphonite: asymmetric allylic substitutions with fenchol-based palladium catalysts. Beilstein journal of organic chemistry 20060101
Catalysis with phosphine-containing amino acids in various 'turn' motifs. The Journal of organic chemistry 20041112
Biosynthesis of cervimycin C, an aromatic polyketide antibiotic bearing an unusual dimethylmalonyl moiety. Organic & biomolecular chemistry 20040907
Synthesis of orthogonally protected (R)- and (S)-2-methylcysteine via an enzymatic desymmeterization and Curtius rearrangement. The Journal of organic chemistry 20030627
Dimethylmalonyltrialkylphosphoranes: new general reagents for esterification reactions allowing controlled inversion or retention of configuration on chiral alcohols. The Journal of organic chemistry 20030221
Electron spin-lattice relaxation in radicals containing two methyl groups, generated by gamma-irradiation of polycrystalline solids. Journal of magnetic resonance (San Diego, Calif. : 1997) 20021201
Proline-based P, N ligands in asymmetric allylation and the Heck reaction. The Journal of organic chemistry 20011102
Properties