Chemical ID: 6395610

c1cc(oc1)CNC(=O)C(F)(F)F
Chemical ID:
6395610
Name [?]:
2,2,2-trifluoro-N-(2-furylmethyl)acetamide
SMILES [?]:
c1cc(oc1)CNC(=O)C(F)(F)F
InChi [?]:
InChI=1/C7H6F3NO2/c8-7(9,10)6(12)11-4-5-2-1-3-13-5/h1-3H,4H2,(H,11,12)
InChi Info:
AuxInfo=1/1/N:1,2,5,6,3,8,10,11,12,13,7,9,4/E:(8,9,10)/rA:13nCCCOCCNCOCFFF/rB:s1;d2;s3;d1s4;s3;s6;s7;d8;s8;s10;s10;s10;/rC:;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H6F3NO2
All Atoms:13
Heavy Atoms:13
Chiral Atoms:0
ZAP Information [?]
Total:5.37012
Area:330.345
Solvation:-2.8885
Coulombic:-49.4922
Bond Count [?]
All:13
Single:10
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:193.123
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:0.82
LogP (Chemaxon):1.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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