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1-Bromo-3-(2-fluoroethoxymethyl)benzene

HCID 15058770
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
FCCOCc1cccc(Br)c1
InChIKey
DUUGXWMILYGNEH-UHFFFAOYSA-N
Molecular formula
C9H10BrFO
Average molar mass
233.08 g/mol

Names & identifiers

Preferred name
1-Bromo-3-(2-fluoroethoxymethyl)benzene
IUPAC
1-bromo-3-(2-fluoroethoxymethyl)benzene

Names & synonyms

SCHEMBL3456515DUUGXWMILYGNEH-UHFFFAOYSA-N1-bromo-3-(2-fluoroethoxymethyl)benzene

Database identifiers

PubChem CID
15058770

Properties

Computed structural properties

XLogP
2.9
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Formal charge
0
Complexity
121

Related reactions

2 records
New reaction record
HRID 30583 reaction equation
HRID 30583As productuspto-grants-2008_09
HRID 2329698 reaction equation
HRID 2329698As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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