Chemical ID: 4118034

Cc1ccc(cc1)I
Chemical ID:
4118034
Name [?]:
1-iodo-4-methyl-benzene
SMILES [?]:
Cc1ccc(cc1)I
InChi [?]:
InChI=1/C7H7I/c1-6-2-4-7(8)5-3-6/h2-5H,1H3
InChi Info:
AuxInfo=1/0/N:1,3,7,4,6,2,5,8/E:(2,3)(4,5)/rA:8nCCCCCCCI/rB:s1;s2;d3;s4;d5;d2s6;s5;/rC:;;;;;;;;

Chemical Details

Atom Count
Formula:C7H7I
All Atoms:8
Heavy Atoms:8
Chiral Atoms:0
ZAP Information [?]
Total:6.80727
Area:287.784
Solvation:-0.387326
Coulombic:-2.02157
Bond Count [?]
All:8
Single:5
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:218.035
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.53
LogP (Chemaxon):3.5

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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