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3-(4-Fluoro-3-phenoxyphenyl)-1-propene

HCID 11075159
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
C=CCc1ccc(F)c(Oc2ccccc2)c1
InChIKey
NFFDKUUHWHPBGS-UHFFFAOYSA-N
Molecular formula
C15H13FO
Average molar mass
228.26 g/mol
Monoisotopic mass
228.0950432

Names & identifiers

Preferred name
3-(4-Fluoro-3-phenoxyphenyl)-1-propene
IUPAC
1-fluoro-2-phenoxy-4-prop-2-enylbenzene

Names & synonyms

SCHEMBL8567439NFFDKUUHWHPBGS-UHFFFAOYSA-N2-fluoro-5-(propen-3-yl)-diphenylether3-(4-fluoro-3-phenoxyphenyl)-1-propene

Database identifiers

PubChem CID
11075159

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
17
Formal charge
0
Complexity
235

Related reactions

4 records
New reaction record
HRID 195300 reaction equation
HRID 195300As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1230228 reaction equation
HRID 1230228As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1639238 reaction equation
HRID 1639238As reactantuspto-grants-1989_11
HRID 1639241 reaction equation
HRID 1639241As reactantuspto-grants-1989_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes