Chemical ID: 6660665

CC(CCC=C(C)C)CC=O
Chemical ID:
6660665
Name [?]:
3,7-dimethyloct-6-enal
SMILES [?]:
CC(CCC=C(C)C)CC=O
InChi [?]:
InChI=1/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,8,10H,4,6-7H2,1-3H3
InChi Info:
AuxInfo=1/0/N:7,8,1,4,5,3,9,10,6,2,11/E:(1,2)/rA:11cCCCCCCCCCCO/rB:s1;s2;s3;s4;d5;s6;s6;s2;s9;d10;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H18O
All Atoms:11
Heavy Atoms:11
Chiral Atoms:1
ZAP Information [?]
Total:7.03456
Area:358.538
Solvation:-1.92889
Coulombic:-8.15048
Bond Count [?]
All:10
Single:8
Double:2
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:154.249
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:3.59
LogP (Chemaxon):2.25

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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