Chemical ID: 7235730

c1(c(c(c(c(c1C(=O)[O-])C(=O)O)C(=O)[O-])C(=O)O)C(=O)[O-])C(=O)O
Chemical ID:
7235730
Name [?]:
2,4,6-tricarboxybenzene-1,3,5-tricarboxylate
SMILES [?]:
c1(c(c(c(c(c1C(=O)[O-])C(=O)O)C(=O)[O-])C(=O)O)C(=O)[O-])C(=O)O
InChi [?]:
InChI=1/C12H6O12/c13-7(14)1-2(8(15)16)4(10(19)20)6(12(23)24)5(11(21)22)3(1)9(17)18/h(H,13,14)(H,15,16)(H,17,18)(H,19,20)(H,21,22)(H,23,24)/p-3
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,22,19,7,16,10,13,23,24,20,21,8,9,17,18,11,12,14,15/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)/gE:(1,2,3,4,5,6)/rA:24nCCCCCCCOO-COOCOO-COOCOO-COO/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s5;d10;s10;s4;d13;s13;s3;d16;s16;s2;d19;s19;s1;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H3O12-3
All Atoms:27
Heavy Atoms:24
Chiral Atoms:None
ZAP Information [?]
Total:-185.129
Area:446.018
Solvation:-196.28
Coulombic:-8.68573
Bond Count [?]
All:24
Single:15
Double:9
Rotors:6
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:-1.73
LogP (Chemaxon):None

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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