Chemical ID: 6717331

c1ccc2c(c1)ccc3c2cc(o3)C(=O)[O-]
Chemical ID:
6717331
Name [?]:
None
SMILES [?]:
c1ccc2c(c1)ccc3c2cc(o3)C(=O)[O-]
InChi [?]:
InChI=1/C13H8O3/c14-13(15)12-7-10-9-4-2-1-3-8(9)5-6-11(10)16-12/h1-7H,(H,14,15)/p-1
InChi Info:
AuxInfo=1/1/N:1,2,6,3,7,8,11,5,4,10,9,12,14,15,16,13/E:(14,15)/rA:16nCCCCCCCCCCCCOCOO-/rB:s1;d2;s3;s4;d1s5;d5;s7;d8;d4s9;s10;d11;s9s12;s12;d14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H7O3-
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-35.9288
Area:373.112
Solvation:-45.2566
Coulombic:-9.91212
Bond Count [?]
All:18
Single:11
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:211.193
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:2.48
LogP (Chemaxon):2.91

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Descriptor Annotations

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