Chemical ID: 5019405

CCOC(=O)c1cc(c(cc1C(=O)OCC)C(=O)OCC)C(=O)OCC
Chemical ID:
5019405
Name [?]:
None
SMILES [?]:
CCOC(=O)c1cc(c(cc1C(=O)OCC)C(=O)OCC)C(=O)OCC
InChi [?]:
InChI=1/C18H22O8/c1-5-23-15(19)11-9-13(17(21)25-7-3)14(18(22)26-8-4)10-12(11)16(20)24-6-2/h9-10H,5-8H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,16,26,21,2,15,25,20,7,10,6,11,8,9,4,12,22,17,5,13,23,18,3,14,24,19/E:(1,2,3,4)(5,6,7,8)(9,10)(11,12,13,14)(15,16,17,18)(19,20,21,22)(23,24,25,26)/rA:26nCCOCOCCCCCCCOOCCCOOCCCOOCC/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;d6s10;s11;d12;s12;s14;s15;s9;d17;s17;s19;s20;s8;d22;s22;s24;s25;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H22O8
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:10.5356
Area:613.491
Solvation:-4.80167
Coulombic:-75.4918
Bond Count [?]
All:26
Single:19
Double:7
Rotors:12
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:366.362
H-Bond Donors:0
H-Bond Acceptors:8
XLogP:3.46
LogP (Chemaxon):1.61

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Descriptor Annotations

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