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5-(2',3'-Difluoro-4'-propoxybiphenyl-4-yl)selenophene-2-carbaldehyde

HCID 59456331
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CCCOc1ccc(-c2ccc(-c3ccc(C=O)[se]3)cc2)c(F)c1F
InChIKey
PUDLOUUEJXUZJS-UHFFFAOYSA-N
Molecular formula
C20H16F2O2Se
Average molar mass
405.3 g/mol

Names & identifiers

Preferred name
5-(2',3'-Difluoro-4'-propoxybiphenyl-4-yl)selenophene-2-carbaldehyde
IUPAC
5-[4-(2,3-difluoro-4-propoxyphenyl)phenyl]selenophene-2-carbaldehyde

Names & synonyms

SCHEMBL3027390SCHEMBL3961844PUDLOUUEJXUZJS-UHFFFAOYSA-N5-(2',3'-difluoro-4'-propoxybiphenyl-4-yl)selenophene-2-carbaldehyde

Database identifiers

PubChem CID
59456331

Properties

Computed structural propertiesFilling in

Topological polar surface area
26.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
25
Formal charge
0
Complexity
428

Related reactions

5 records
New reaction record
HRID 304299 reaction equation
HRID 304299As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 670851 reaction equation
HRID 670851As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1873413 reaction equation
HRID 1873413As productuspto-grants-2012_11
HRID 1873414 reaction equation
HRID 1873414As reactantuspto-grants-2012_11
HRID 1873416 reaction equation
HRID 1873416As reactantuspto-grants-2012_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes