Chemical ID: 6837897

c1c[nH+]c(cc1I)Br
Chemical ID:
6837897
Name [?]:
6-bromo-4-iodo-1H-pyridine
SMILES [?]:
c1c[nH+]c(cc1I)Br
InChi [?]:
InChI=1/C5H3BrIN/c6-5-3-4(7)1-2-8-5/h1-3H/p+1
InChi Info:
AuxInfo=1/1/N:1,2,5,6,4,8,7,3/rA:8nCCN+CCCIBr/rB:s1;d2;s3;d4;d1s5;s6;s4;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C5H4BrIN+
All Atoms:12
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:-26.7636
Area:295.429
Solvation:-34.1493
Coulombic:10.1796
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:284.9
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.72
LogP (Chemaxon):2.91

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Descriptor Annotations

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