Chemical ID: 5147817

CC(=O)C1CC2CCC1C=C2
Chemical ID:
5147817
Name [?]:
1-(8-bicyclo[2.2.2]oct-5-enyl)ethanone
SMILES [?]:
CC(=O)C1CC2CCC1C=C2
InChi [?]:
InChI=1/C10H14O/c1-7(11)10-6-8-2-4-9(10)5-3-8/h2,4,8-10H,3,5-6H2,1H3
InChi Info:
AuxInfo=1/0/N:1,11,7,10,8,5,2,6,9,4,3/rA:11cCCOCCCCCCCC/rB:s1;d2;s2;s4;s5;s6;s7;s4s8;s9;s6d10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H14O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:3
ZAP Information [?]
Total:5.89039
Area:297.012
Solvation:-1.53492
Coulombic:-8.1245
Bond Count [?]
All:12
Single:10
Double:2
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:150.218
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.25
LogP (Chemaxon):2.15

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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