1-(4-Hydroxy-3,5-di-isopropylphenyl)-2-iodo-ethanone

HCID 57747236
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Basic information

Standard SMILES
CC(C)c1cc(C(=O)CI)cc(C(C)C)c1O
InChIKey
WMOQURFPNWPFAU-UHFFFAOYSA-N
Molecular formula
C14H19IO2
Average molar mass
346.2 g/mol
Monoisotopic mass
346.04298

Names & identifiers

Preferred name
1-(4-Hydroxy-3,5-di-isopropylphenyl)-2-iodo-ethanone
IUPAC
1-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-2-iodoethanone

Names & synonyms

SCHEMBL2482630WMOQURFPNWPFAU-UHFFFAOYSA-N1-(4-hydroxy-3,5-di-isopropylphenyl)-2-iodo-ethanone

Database identifiers

PubChem CID
57747236

Properties

Computed structural properties

XLogP
4.2
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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