Chemical ID: 4122458

CC(C)(C)c1ccc2c(c1)OCC(O2)C(=O)O
Chemical ID:
4122458
Name [?]:
8-tert-butyl-2,5-dioxabicyclo[4.4.0]deca-7,9,11-triene-3-carboxylic acid
SMILES [?]:
CC(C)(C)c1ccc2c(c1)OCC(O2)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H16O4
All Atoms:17
Heavy Atoms:17
Chiral Atoms:1
ZAP Information [?]
Total:7.21391
Area:408.937
Solvation:-3.00952
Coulombic:-45.3641
Bond Count [?]
All:18
Single:14
Double:4
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:236.264
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.94
LogP (Chemaxon):2.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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