Chemical ID: 3964453

c1cc(c(cc1O)F)[N+](=O)[O-]
Chemical ID:
3964453
Name [?]:
3-fluoro-4-nitro-phenol
SMILES [?]:
c1cc(c(cc1O)F)[N+](=O)[O-]
InChi [?]:
InChI=1/C6H4FNO3/c7-5-3-4(9)1-2-6(5)8(10)11/h1-3,9H
InChi Info:
AuxInfo=1/0/N:1,2,5,6,4,3,8,9,7,10,11/E:(10,11)/CRV:8.5/rA:11nCCCCCCOFN+OO-/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;d9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H4FNO3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:-2.22886
Area:289.871
Solvation:-9.47563
Coulombic:-27.9689
Bond Count [?]
All:11
Single:7
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:157.099
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:1.55
LogP (Chemaxon):1.86

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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