Chemical ID: 4916904

CCCC(=O)OC1C2C(OC1C(CO)O)OC(O2)(C)C
Chemical ID:
4916904
Name [?]:
[7-(1,2-dihydroxyethyl)-3,3-dimethyl-2,4,6-trioxabicyclo[3.3.0]oct-8-yl] butanoate
SMILES [?]:
CCCC(=O)OC1C2C(OC1C(CO)O)OC(O2)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H22O7
All Atoms:20
Heavy Atoms:20
Chiral Atoms:5
ZAP Information [?]
Total:6.24024
Area:473.153
Solvation:-5.58859
Coulombic:-78.8122
Bond Count [?]
All:21
Single:20
Double:1
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:290.31
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:-0.01
LogP (Chemaxon):0.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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