Octadecyl o-iodobenzoate

HCID 12945188
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Basic information

Standard SMILES
CCCCCCCCCCCCCCCCCCOC(=O)c1ccccc1I
InChIKey
SCUSGQQOVCIYRQ-UHFFFAOYSA-N
Molecular formula
C25H41IO2
Average molar mass
500.5 g/mol

Names & identifiers

Preferred name
Octadecyl o-iodobenzoate
IUPAC
octadecyl 2-iodobenzoate

Names & synonyms

octadecyl o-iodobenzoateSCHEMBL11328499SCUSGQQOVCIYRQ-UHFFFAOYSA-N

Database identifiers

PubChem CID
12945188

Properties

Computed structural properties

XLogP
11.6
Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
19
Heavy atoms
28

Related reactions

2 records
New reaction record

Linked notes

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