Chemical ID: 5829498

C1CCCC(=NO)C(=NO)CC1
Chemical ID:
5829498
Name [?]:
cyclooctane-1,2-dione oxime
SMILES [?]:
C1CCCC(=NO)C(=NO)CC1
InChi [?]:
InChI=1/C8H14N2O2/c11-9-7-5-3-1-2-4-6-8(7)10-12/h11-12H,1-6H2
InChi Info:
AuxInfo=1/0/N:1,2,12,3,11,4,8,5,9,6,10,7/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)/rA:12nCCCCCNOCNOCC/rB:s1;s2;s3;s4;w5;s6;s5;w8;s9;s8;s1s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H14N2O2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.55879
Area:321.526
Solvation:-2.47936
Coulombic:-25.349
Bond Count [?]
All:12
Single:10
Double:2
Rotors:0
Chiral:2
Rigid Segments:1
Chemical Properties
Molecular Weight:170.209
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.55
LogP (Chemaxon):2.32

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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