Chemical ID: 4116859

c1cc(sc1)I
Chemical ID:
4116859
Name [?]:
2-iodothiophene
SMILES [?]:
c1cc(sc1)I
InChi [?]:
InChI=1/C4H3IS/c5-4-2-1-3-6-4/h1-3H
InChi Info:
AuxInfo=1/0/N:1,2,5,3,6,4/rA:6nCCCSCI/rB:s1;d2;s3;d1s4;s3;/rC:;;;;;;

Chemical Details

Atom Count
Formula:C4H3IS
All Atoms:6
Heavy Atoms:6
Chiral Atoms:0
ZAP Information [?]
Total:6.16285
Area:263.497
Solvation:-0.424576
Coulombic:-1.64144
Bond Count [?]
All:6
Single:4
Double:2
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:210.037
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:2.15
LogP (Chemaxon):2.63

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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