Chemical ID: 5139056

CCOC(=O)C(=C(C(=O)OCC)C(=O)OCC)C
Chemical ID:
5139056
Name [?]:
None
SMILES [?]:
CCOC(=O)C(=C(C(=O)OCC)C(=O)OCC)C
InChi [?]:
InChI=1/C12H18O6/c1-5-16-10(13)8(4)9(11(14)17-6-2)12(15)18-7-3/h5-7H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,12,17,18,2,11,16,6,7,4,8,13,5,9,14,3,10,15/E:(2,3)(6,7)(11,12)(14,15)(17,18)/rA:18nCCOCOCCCOOCCCOOCCC/rB:s1;s2;s3;d4;s4;d6;s7;d8;s8;s10;s11;s7;d13;s13;s15;s16;s6;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H18O6
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.65065
Area:477.023
Solvation:-3.27492
Coulombic:-56.2847
Bond Count [?]
All:17
Single:13
Double:4
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:258.268
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:2.07
LogP (Chemaxon):0.95

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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