Chemical ID: 7727582

COc1ccc2c(c1)OC(=Cc3cccc(c3)OCC(=O)OC)C2=O
Chemical ID:
7727582
Name [?]:
None
SMILES [?]:
COc1ccc2c(c1)OC(=Cc3cccc(c3)OCC(=O)OC)C2=O
InChi [?]:
InChI=1/C19H16O6/c1-22-13-6-7-15-16(10-13)25-17(19(15)21)9-12-4-3-5-14(8-12)24-11-18(20)23-2/h3-10H,11H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,23,14,13,15,4,5,17,11,8,19,12,3,16,6,7,10,20,24,21,25,2,22,18,9/rA:25nCOCCCCCCOCCCCCCCCOCCOOCCO/rB:s1;s2;s3;d4;s5;d6;d3s7;s7;s9;w10;s11;s12;d13;s14;d15;d12s16;s16;s18;s19;d20;s20;s22;s6s10;d24;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H16O6
All Atoms:41
Heavy Atoms:25
Chiral Atoms:None
ZAP Information [?]
Total:8.01291
Area:563.609
Solvation:-6.07731
Coulombic:-50.9282
Bond Count [?]
All:27
Single:18
Double:9
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:3.16
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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