Chemical ID: 4148671

CC(C)OC(=O)COc1ccc2c(c1)oc(c(c2=O)Oc3ccc(cc3)OC)C(F)(F)F
Chemical ID:
4148671
Name [?]:
isopropyl 2-[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate
SMILES [?]:
CC(C)OC(=O)COc1ccc2c(c1)oc(c(c2=O)Oc3ccc(cc3)OC)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H19F3O7
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:8.77691
Area:639.757
Solvation:-7.21702
Coulombic:-76.1771
Bond Count [?]
All:34
Single:25
Double:9
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:452.377
H-Bond Donors:0
H-Bond Acceptors:6
XLogP:4.84
LogP (Chemaxon):4.07

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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