Chemical ID: 6049374

c1c(c(c(c(c1F)F)F)F)C(=NO)N
Chemical ID:
6049374
Name [?]:
amino-(2,3,4,5-tetrafluorophenyl)-methanone oxime
SMILES [?]:
c1c(c(c(c(c1F)F)F)F)C(=NO)N
InChi [?]:
InChI=1/C7H4F4N2O/c8-3-1-2(7(12)13-14)4(9)6(11)5(3)10/h1,14H,(H2,12,13)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,5,4,11,7,10,8,9,14,12,13/rA:14nCCCCCCFFFFCNON/rB:s1;d2;s3;d4;d1s5;s6;s5;s4;s3;s2;w11;s12;s11;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H4F4N2O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:3.00224
Area:318.583
Solvation:-4.96233
Coulombic:-41.6915
Bond Count [?]
All:14
Single:10
Double:4
Rotors:1
Chiral:1
Rigid Segments:2
Chemical Properties
Molecular Weight:208.113
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.11
LogP (Chemaxon):1.39

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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