Chemical ID: 6317928

COC(=O)CCCCCCCCCCC(=O)OC
Chemical ID:
6317928
Name [?]:
dimethyl dodecanedioate
SMILES [?]:
COC(=O)CCCCCCCCCCC(=O)OC
InChi [?]:
InChI=1/C14H26O4/c1-17-13(15)11-9-7-5-3-4-6-8-10-12-14(16)18-2/h3-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,18,9,10,8,11,7,12,6,13,5,14,3,15,4,16,2,17/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)(13,14)(15,16)(17,18)/rA:18nCOCOCCCCCCCCCCCOOC/rB:s1;s2;d3;s3;s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;d15;s15;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H26O4
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:10.338
Area:537.321
Solvation:-3.09504
Coulombic:-37.0705
Bond Count [?]
All:17
Single:15
Double:2
Rotors:13
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:258.354
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:4.06
LogP (Chemaxon):2.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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