2-n-Butyl-5-hydroxymethyl-4-iodoimidazole

HCID 14898547
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Basic information

Standard SMILES
CCCCc1nc(I)c(CO)[nH]1
InChIKey
DKHPIBAKKVXLDL-UHFFFAOYSA-N
Molecular formula
C8H13IN2O
Average molar mass
280.11 g/mol
Monoisotopic mass
280.00726

Names & identifiers

Preferred name
2-n-Butyl-5-hydroxymethyl-4-iodoimidazole
IUPAC
(2-butyl-4-iodo-1H-imidazol-5-yl)methanol

Names & synonyms

2-n-Butyl-5-hydroxymethyl-4-iodoimidazoleSCHEMBL8435741DKHPIBAKKVXLDL-UHFFFAOYSA-NAKOS0002791222-butyl-5-hydroxymethyl-4-iodoimidazole2-Butyl-5-hydroxymethyl-4-iodo-imidazoleAU-059/43521701(2-BUTYL-5-IODO-1H-IMIDAZOL-4-YL)METHANOL

Database identifiers

PubChem CID
14898547

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
48.9 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12

Related reactions

12 records
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Linked notes

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