Chemical ID: 4945173

CCOC(=O)C(C)[OH2+]
Chemical ID:
4945173
Name [?]:
1-ethoxycarbonylethyloxonium
SMILES [?]:
CCOC(=O)C(C)[OH2+]
InChi [?]:
InChI=1/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3/p+1
InChi Info:
AuxInfo=1/1/N:1,7,2,6,4,8,5,3/rA:8cCCOCOCCO+/rB:s1;s2;s3;d4;s4;s6;s6;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H11O3+
All Atoms:8
Heavy Atoms:8
Chiral Atoms:1
ZAP Information [?]
Total:-31.9669
Area:279.913
Solvation:-38.9647
Coulombic:-46.9522
Bond Count [?]
All:7
Single:6
Double:1
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:119.139
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.15
LogP (Chemaxon):0.19

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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