chempirical

2,2-Dimethylsuccinic anhydride

C6H8O3CAS 17347-61-4128.13 g/mol

Open in Covalent MOL file
OOO
Acid anhydride

Properties

Molecular formula
C6H8O3
Molar mass
128.13 g/mol
Exact mass
128.0473 Da
Boiling point
102–103 °C (at 15 Torr)
logP
0.49Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
0

Identifiers

CAS number
17347-61-4
SMILES
CC1(C)CC(=O)OC1=O
InChIKey
ACJPFLIEHGFXGP-UHFFFAOYSA-N
InChI
InChI=1S/C6H8O3/c1-6(2)3-4(7)9-5(6)8/h3H2,1-2H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

10 names
  • 2,5-Furandione, dihydro-3,3-dimethyl-
  • Succinic anhydride, 2,2-dimethyl-
  • Succinic anhydride, α,α-dimethyl-
  • Dihydro-3,3-dimethyl-2,5-furandione
  • α,α-Dimethylsuccinic anhydride
  • 3,4-Dihydro-3,3-dimethylfuran-2,5-dione
  • 3,3-Dimethyl-3,4-dihydro-2,5-furandione
  • 3,3-Dimethyldihydrofuran-2,5-dione
  • 3,3-Dimethyltetrahydrofuran-2,5-dione
  • 3,3-Dimethyloxolane-2,5-dione

Work with 2,2-Dimethylsuccinic anhydride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,2-Dimethylglutaric anhydride2938-48-963 % similar Dihydro-4,4-dimethyl-2H-pyran-2,6(3H)-dione4160-82-150 % similar 1-Methyl 2,2-dimethylbutanedioate32980-26-042 % similar Pivalic anhydride1538-75-638 % similar 8-Oxaspiro[4.5]decane-7,9-dione5662-95-338 % similar Methyl 3-hydroxy-2,2-dimethylpropanoate14002-80-338 % similar Trimethyl citrate1587-20-836 % similar Boron, [2-hydroxy-1,2,3-propanetricarboxylato(3-)]-, (T-4)-74231-02-035 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Glycidyl acrylate106-90-1 Ketopantolactone13031-04-4 2,5-Bis(hydroxymethyl)furan1883-75-6 Adipic anhydride2035-75-8 Sotolon28664-35-9 Ethyl (2E)-4-oxo-2-butenoate2960-66-9 Furaneol3658-77-3 Dihydro-4-methyl-2H-pyran-2,6(3H)-dione4166-53-4

Elsewhere

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