Chemical ID: 4554827

C1CCCCCC=CCCCC1
Chemical ID:
4554827
Name [?]:
cyclododecene
SMILES [?]:
C1CCCCCC=CCCCC1
InChi [?]:
InChI=1/C12H22/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2H,3-12H2
InChi Info:
AuxInfo=1/0/N:7,8,6,9,5,10,4,11,3,12,2,1/E:(1,2)(3,4)(5,6)(7,8)(9,10)(11,12)/rA:12nCCCCCCCCCCCC/rB:s1;s2;s3;s4;s5;s6;w7;s8;s9;s10;s1s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C12H22
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:8.05441
Area:329.634
Solvation:-0.186441
Coulombic:-4.0319
Bond Count [?]
All:12
Single:11
Double:1
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:166.303
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:5.05
LogP (Chemaxon):4.5

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