Chemical ID: 6698562

C1C2C=CC1C(C2C(=O)[O-])C(=O)[O-]
Chemical ID:
6698562
Name [?]:
bicyclo[2.2.1]hept-2-ene-5,6-dicarboxylate
SMILES [?]:
C1C2C=CC1C(C2C(=O)[O-])C(=O)[O-]
InChi [?]:
InChI=1/C9H10O4/c10-8(11)6-4-1-2-5(3-4)7(6)9(12)13/h1-2,4-7H,3H2,(H,10,11)(H,12,13)/p-2
InChi Info:
AuxInfo=1/1/N:3,4,1,2,5,7,6,8,11,9,10,12,13/E:(1,2)(4,5)(6,7)(8,9)(10,11,12,13)/gE:(1,2)/rA:13cCCCCCCCCOO-COO-/rB:s1;s2;d3;s1s4;s5;s2s6;s7;d8;s8;s6;d11;s11;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H8O4-2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:4
ZAP Information [?]
Total:-105.237
Area:319.201
Solvation:-113.217
Coulombic:33.6094
Bond Count [?]
All:14
Single:11
Double:3
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:180.157
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:-0.71
LogP (Chemaxon):0.54

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