Chemical ID: 6428334

CC(=C1CCC2(C1)C3=C(CCC2=O)C(=O)CCC3)C
Chemical ID:
6428334
Name [?]:
None
SMILES [?]:
CC(=C1CCC2(C1)C3=C(CCC2=O)C(=O)CCC3)C
InChi [?]:
InChI=1/C17H22O2/c1-11(2)12-8-9-17(10-12)14-4-3-5-15(18)13(14)6-7-16(17)19/h3-10H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,19,17,18,16,10,11,4,5,7,2,3,9,8,14,12,6,15,13/E:(1,2)/rA:19cCCCCCCCCCCCCOCOCCCC/rB:s1;d2;s3;s4;s5;s3s6;s6;d8;s9;s10;s6s11;d12;s9;d14;s14;s16;s8s17;s2;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H22O2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:8.16237
Area:434.438
Solvation:-2.69857
Coulombic:-15.2411
Bond Count [?]
All:21
Single:17
Double:4
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:258.355
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:1.58
LogP (Chemaxon):3.44

Name Annotations

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Descriptor Annotations

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