Chemical ID: 4555959

CC1(CCCC2(C13CCC(C3)C2(C)C)O)C
Chemical ID:
4555959
Name [?]:
None
SMILES [?]:
CC1(CCCC2(C13CCC(C3)C2(C)C)O)C
InChi [?]:
InChI=1/C15H26O/c1-12(2)7-5-8-15(16)13(3,4)11-6-9-14(12,15)10-11/h11,16H,5-10H2,1-4H3
InChi Info:
AuxInfo=1/0/N:1,16,13,14,4,9,3,5,8,11,10,2,12,7,6,15/E:(1,2)(3,4)/rA:16cCCCCCCCCCCCCCCOC/rB:s1;s2;s3;s4;s5;s2s6;s7;s8;s9;s7s10;s6s10;s12;s12;s6;s2;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H26O
All Atoms:16
Heavy Atoms:16
Chiral Atoms:3
ZAP Information [?]
Total:7.94023
Area:360.067
Solvation:-1.06143
Coulombic:-19.5422
Bond Count [?]
All:18
Single:18
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:222.366
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.43
LogP (Chemaxon):3.77

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Descriptor Annotations

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