2',4',6'-Triiodo-3-nitrobiphenyl-4-carbonyl chloride

HCID 22342001
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Basic information

Standard SMILES
O=C(Cl)c1ccc(-c2c(I)cc(I)cc2I)cc1[N+](=O)[O-]
InChIKey
RARDSXHNHAJHKR-UHFFFAOYSA-N
Molecular formula
C13H5ClI3NO3
Average molar mass
639.35 g/mol
Monoisotopic mass
638.7092

Names & identifiers

Preferred name
2',4',6'-Triiodo-3-nitrobiphenyl-4-carbonyl chloride
IUPAC
2-nitro-4-(2,4,6-triiodophenyl)benzoyl chloride

Names & synonyms

SCHEMBL2333325RARDSXHNHAJHKR-UHFFFAOYSA-N2',4',6'-triiodo-3-nitrobiphenyl-4-carbonyl chloride

Database identifiers

PubChem CID
22342001

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
62.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
21

Related reactions

6 records
New reaction record

Compound notes

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