1-fluoro-2-(1-iodoethenyl)benzene

C8H6FI — CID 134999703

IUPAC1-fluoro-2-(1-iodoethenyl)benzene
SMILESC=C(I)c1ccccc1F
InChIInChI=1S/C8H6FI/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,1H2
InChIKeyHECKHWUVHYTHIO-UHFFFAOYSA-N
MW248.04 g/mol
LogP3.23
Rot. Bonds1

About 1-fluoro-2-(1-iodoethenyl)benzene

1-fluoro-2-(1-iodoethenyl)benzene (PubChem CID 134999703) has the molecular formula C8H6FI and a molecular weight of 248.04 g/mol. Its IUPAC name is 1-fluoro-2-(1-iodoethenyl)benzene.

Molecular Properties

Compound Name1-fluoro-2-(1-iodoethenyl)benzene
PubChem CID134999703
Molecular FormulaC8H6FI
Molecular Weight248.04 g/mol
Exact Mass247.95
IUPAC Name1-fluoro-2-(1-iodoethenyl)benzene
SMILESC=C(I)c1ccccc1F
InChIInChI=1S/C8H6FI/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,1H2
InChIKeyHECKHWUVHYTHIO-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.04
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

1-fluoro-2-(3-iodoprop-1-en-2-yl)benzene
CID 140862790
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183
1-(2-fluorophenyl)-N-methoxyethenamine
CID 57082075
2-fluorobenzoyl chloride
CID 9808
2-(2-fluorophenyl)ethene-1,1,2-tricarbonitrile
CID 91181547
2-fluorobenzamide;dihydrochloride
CID 22563899
2-fluorobenzoyl chloride;hydrochloride
CID 172728813
ethane;2-fluorobenzoic acid
CID 91182768
lithium 2-fluorobenzoate
CID 19205780
1-[(3Z)-2-chlorohexa-1,3,5-trien-3-yl]-2-fluorobenzene
CID 145265931
1,2-difluoro-3-(3-iodoprop-1-en-2-yl)benzene
CID 18993725
2-fluorobenzoic acid;oxalic acid;hydrate
CID 172785033

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(1-iodoethenyl)benzene?
The IUPAC name of 1-fluoro-2-(1-iodoethenyl)benzene (CID 134999703) is 1-fluoro-2-(1-iodoethenyl)benzene.
What is the SMILES notation for 1-fluoro-2-(1-iodoethenyl)benzene?
The canonical SMILES for 1-fluoro-2-(1-iodoethenyl)benzene is C=C(I)c1ccccc1F.
What is the InChIKey of 1-fluoro-2-(1-iodoethenyl)benzene?
The InChIKey is HECKHWUVHYTHIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FI/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,1H2.
What are the key properties of 1-fluoro-2-(1-iodoethenyl)benzene?
1-fluoro-2-(1-iodoethenyl)benzene has a molecular weight of 248.04 g/mol, XLogP of 3.23, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-(1-iodoethenyl)benzene is sourced from PubChem (CID 134999703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).