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1121-86-4 | 1-Fluoro-3-iodobenzene
CAS No: 1121-86-4 Catalog No: AG0032RG MDL No:MFCD00001044
Product Description
Catalog Number:
AG0032RG
Chemical Name:
1-Fluoro-3-iodobenzene
CAS Number:
1121-86-4
Molecular Formula:
C6H4FI
Molecular Weight:
221.9988
MDL Number:
MFCD00001044
IUPAC Name:
1-fluoro-3-iodobenzene
InChI:
InChI=1S/C6H4FI/c7-5-2-1-3-6(8)4-5/h1-4H
InChI Key:
VSKSBSORLCDRHS-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)I
EC Number:
214-339-9
NSC Number:
10279
Properties
Complexity:
74.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.934g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
222.001g/mol
Monoisotopic Mass:
221.934g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| Gene expression signatures and small-molecule compounds link a protein kinase to Plasmodium falciparum motility. | Nature chemical biology 20080601 |
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