Chemical ID: 4115438

COC(=O)C(Cc1ccc(cc1)OC(F)(F)F)Br
Chemical ID:
4115438
Name [?]:
methyl 2-bromo-3-[4-(trifluoromethoxy)phenyl]-propanoate
SMILES [?]:
COC(=O)C(Cc1ccc(cc1)OC(F)(F)F)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C11H10BrF3O3
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:8.34789
Area:426.134
Solvation:-2.30545
Coulombic:-51.7077
Bond Count [?]
All:18
Single:14
Double:4
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:327.095
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:3.72
LogP (Chemaxon):3.4

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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