Chemical ID: 4114976

c1cc(c(cc1N)Cl)F
Chemical ID:
4114976
Name [?]:
3-chloro-4-fluoro-aniline
SMILES [?]:
c1cc(c(cc1N)Cl)F
InChi [?]:
InChI=1/C6H5ClFN/c7-5-3-4(9)1-2-6(5)8/h1-3H,9H2
InChi Info:
AuxInfo=1/0/N:1,2,5,6,4,3,8,9,7/rA:9nCCCCCCNClF/rB:s1;d2;s3;d4;d1s5;s6;s4;s3;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5ClFN
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:5.38519
Area:278.94
Solvation:-1.5883
Coulombic:-20.8847
Bond Count [?]
All:9
Single:6
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:145.562
H-Bond Donors:2
H-Bond Acceptors:1
XLogP:1.99
LogP (Chemaxon):1.92

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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