Chemical ID: 7590555

c1cc2ccc3c(ccc4c3c2c5c1ccc6c5c4c(cc6)[N+](=O)[O-])[N+](=O)[O-]
Chemical ID:
7590555
Name [?]:
None
SMILES [?]:
c1cc2ccc3c(ccc4c3c2c5c1ccc6c5c4c(cc6)[N+](=O)[O-])[N+](=O)[O-]
InChi [?]:
InChI=1/C22H10N2O4/c25-23(26)16-10-8-15-21-14(16)7-5-12-3-1-11-2-4-13-6-9-17(24(27)28)22(15)20(13)18(11)19(12)21/h1-10H
InChi Info:
AuxInfo=1/0/N:1,15,2,16,4,22,5,9,21,8,14,3,17,6,10,7,20,13,12,18,11,19,26,23,27,28,24,25/E:(25,26)(27,28)/CRV:23.5,24.5/rA:28nCCCCCCCCCCCCCCCCCCCCCCN+OO-N+OO-/rB:s1;d2;s3;d4;s5;s6;d7;s8;d9;d6s10;s3s11;d12;d1s13;s14;d15;s16;s13s17;s10d18;s19;d20;d17s21;s20;d23;s23;s7;d26;s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H10N2O4
All Atoms:38
Heavy Atoms:28
Chiral Atoms:None
ZAP Information [?]
Total:1.42431
Area:488.554
Solvation:-10.7895
Coulombic:-27.2645
Bond Count [?]
All:33
Single:20
Double:13
Rotors:2
Chiral:None
Rigid Segments:None
Chemical Properties
Molecular Weight:None
H-Bond Donors:None
H-Bond Acceptors:None
XLogP:6.54
LogP (Chemaxon):None

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue