Chemical ID: 5647683

c1cc(=O)oc2c1cc3ccoc3c2O
Chemical ID:
5647683
Name [?]:
None
SMILES [?]:
c1cc(=O)oc2c1cc3ccoc3c2O
InChi [?]:
InChI=1/C11H6O4/c12-8-2-1-6-5-7-3-4-14-10(7)9(13)11(6)15-8/h1-5,13H
InChi Info:
AuxInfo=1/0/N:1,2,10,11,8,7,9,3,14,13,6,4,15,12,5/rA:15nCCCOOCCCCCCOCCO/rB:d1;s2;d3;s3;s5;s1s6;d7;s8;s9;d10;s11;d9s12;d6s13;s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H6O4
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:4.27982
Area:347.717
Solvation:-4.4131
Coulombic:-41.0776
Bond Count [?]
All:17
Single:11
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:202.163
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:1.41
LogP (Chemaxon):3.06

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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