C1=CC(=CN=C1)I
CAS: 1120-90-7
Name: 3-iodopyridine
SMILES: C1=CC(=CN=C1)I

Molecular Processing

Molecular formula
C5H4IN
Molecular weight
205
Exact mass
204.9388
XLogP
1.69
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
7
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
36.95

Supplementary Information

InChIKey: XDELKSRGBLWMBA-UHFFFAOYSA-N
Synonyms
3-Iodopyridine1120-90-7Pyridine, 3-iodo-LWL4FC4MZMNSC-5076EINECS 214-322-6DTXSID10149813NSC 5076RefChem:94469DTXCID0072304214-322-6InChI=1/C5H4IN/c6-5-2-1-3-7-4-5/h1-43-Iodo-pyridineMFCD000235533-Iodo pyridineCHEMBL54347353-Pyridyl iodide; NSC 5076NSC5076UNII-LWL4FC4MZM3-Iodopyridine, 98%SCHEMBL10515SCHEMBL488381SCHEMBL1361305SCHEMBL1448773SCHEMBL1766652SCHEMBL29579181CS-D1693BDBM50622788CL0133SBB054246
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