2-Fluoro-4-iodobenzoyl isocyanate

HCID 90018656
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Basic information

Standard SMILES
O=C=NC(=O)c1ccc(I)cc1F
InChIKey
LEKNDLHNIMDXBL-UHFFFAOYSA-N
Molecular formula
C8H3FINO2
Average molar mass
291.02 g/mol

Names & identifiers

Preferred name
2-Fluoro-4-iodobenzoyl isocyanate
IUPAC
2-fluoro-4-iodobenzoyl isocyanate

Names & synonyms

SCHEMBL155397272-fluoro-4-iodobenzoyl isocyanateLEKNDLHNIMDXBL-UHFFFAOYSA-N

Database identifiers

PubChem CID
90018656

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
46.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
13

Related reactions

4 records
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Compound notes

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