Chemical ID: 4149049

CC(C)COC(=O)COc1ccc2c(c1)oc(c(c2=O)c3ccccc3OC)C(F)(F)F
Chemical ID:
4149049
Name [?]:
isobutyl 2-[3-(2-methoxyphenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate
SMILES [?]:
CC(C)COC(=O)COc1ccc2c(c1)oc(c(c2=O)c3ccccc3OC)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H21F3O6
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:9.95469
Area:648.687
Solvation:-6.26248
Coulombic:-70.1279
Bond Count [?]
All:34
Single:25
Double:9
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:450.404
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:5.08
LogP (Chemaxon):4.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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