General Information of DIG (ID: E0G9PF)
DIG Name
Dimethyl isosorbide
Synonyms    Click to Show/Hide the Synonyms of This DIG
Dimethyl isosorbide; 5306-85-4; Isosorbide dimethyl ether; (3R,3aR,6S,6aR)-3,6-Dimethoxyhexahydrofuro[3,2-b]furan; 1,4:3,6-Dianhydro-2,5-di-O-methyl-D-glucitol; UNII-SA6A6V432S; (3S,3aR,6R,6aR)-3,6-dimethoxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan; SA6A6V432S; MFCD00064828; dimethyl isosorbide ether; Isosorbide dimethyl ether, 99%; 2,5-Dimethylisosorbide; D-Glucitol, 1,4:3,6-dianhydro-2,5-di-O-methyl-; 2,5-Di-O-methyl-1,4:3,6-dianhydro-D-glucitol; EINECS 226-159-8; NSC 40727; NSC 44695; Isosorbide, dimethyl ether; Sorbitol, 1,4:3,6-dianhydro-2,5-di-O-methyl-; SCHEMBL301881; Glucitol, 1,4:3,6-dianhydro-2,5-di-O-methyl-, D-; Isosorbide dimethyl ether, 98%; DTXSID201019399; NSC40727; NSC44695; ZINC1849546; NSC-40727; NSC-44695; AKOS016010544; AS-17682; AB0020429; I0390; ST50405701; V1292; 1,4:3,6-Dianhydro-D-glucitol dimethyl ether; M-2731; D-Glucitol, 1,4:3,6-dianhydro-2,5-di-O-methyl; Q5807233; (3R,3aR,6S,6aR)-3,6-dimethoxy-hexahydrofuro[3,2-b]furan; (4S,1R,5R,8R)-4,8-dimethoxy-2,6-dioxabicyclo[3.3.0]octane
DIG Function
Solvent
PubChem CID
62990
Formula
C8H14O4
Canonical SMILES
CO[C@@H]1CO[C@H]2[C@@H]1OC[C@@H]2OC
InChI
1S/C8H14O4/c1-9-5-3-11-8-6(10-2)4-12-7(5)8/h5-8H,3-4H2,1-2H3/t5-,6+,7-,8-/m1/s1
InChIKey
MEJYDZQQVZJMPP-ULAWRXDQSA-N
   Click to Show/Hide the Molecular Data (Structure/Property) of This DIG
Structure
<iframe style="width: 300px; height: 300px;" frameborder="0" src="https://embed.molview.org/v1/?mode=balls&cid=62990"></iframe>
3D MOL 2D MOL
Physicochemical Properties Molecular Weight 174.19 Topological Polar Surface Area 36.9
XlogP -0.6 Complexity 143
Heavy Atom Count 12 Rotatable Bond Count 2
Hydrogen Bond Donor Count 0 Hydrogen Bond Acceptor Count 4

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