Chemical ID: 4945079

CCCCCCCCCCCCCCCCCC(=O)[OH2+]
Chemical ID:
4945079
Name [?]:
octadecanoyloxonium
SMILES [?]:
CCCCCCCCCCCCCCCCCC(=O)[OH2+]
InChi [?]:
InChI=1/C18H36O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2-17H2,1H3,(H,19,20)/p+1
InChi Info:
AuxInfo=1/1/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20/E:(19,20)/rA:20nCCCCCCCCCCCCCCCCCCOO+/rB:s1;s2;s3;s4;s5;s6;s7;s8;s9;s10;s11;s12;s13;s14;s15;s16;s17;d18;s18;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H37O2+
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:-26.8979
Area:615.377
Solvation:-42.2823
Coulombic:-38.6457
Bond Count [?]
All:19
Single:18
Double:1
Rotors:16
Chiral:0
Rigid Segments:9
Chemical Properties
Molecular Weight:285.485
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:7.02
LogP (Chemaxon):6.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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