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1-Iodo-4-(1-methoxyethoxymethoxy)benzene (HCID 21972283)|Huagongshe
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Compound
1-Iodo-4-(1-methoxyethoxymethoxy)benzene
HCID
21972283
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Compound notes
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Basic information
Standard SMILES
COC(C)OCOc1ccc(I)cc1
InChIKey
YZDDJRVYLCVLGZ-UHFFFAOYSA-N
Molecular formula
C10H13IO3
Average molar mass
308.11 g/mol
Names & identifiers
Preferred name
1-Iodo-4-(1-methoxyethoxymethoxy)benzene
IUPAC
1-iodo-4-(1-methoxyethoxymethoxy)benzene
Names & synonyms
SCHEMBL4185403
Database identifiers
PubChem CID
21972283
Properties
Computed structural properties
XLogP
2.9
Topological polar surface area
27.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
14
Formal charge
0
Complexity
146
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Related reactions
1 records
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As reactant
As product
As reagent
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As solvent
HRID
2350321
As product
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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