4-Ethoxy-3,3'-difluoro-4'-butoxybiphenyl

HCID 12067446
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Basic information

Standard SMILES
CCCCOc1ccc(-c2ccc(OCC)c(F)c2)cc1F
InChIKey
NHAOKXQAUZCBFL-UHFFFAOYSA-N
Molecular formula
C18H20F2O2
Average molar mass
306.3 g/mol
Monoisotopic mass
306.1431362

Names & identifiers

Preferred name
4-Ethoxy-3,3'-difluoro-4'-butoxybiphenyl
IUPAC
1-butoxy-4-(4-ethoxy-3-fluorophenyl)-2-fluorobenzene

Names & synonyms

SCHEMBL5865754NHAOKXQAUZCBFL-UHFFFAOYSA-N4-ethoxy-3,3'-difluoro-4'-butoxybiphenyl

Database identifiers

PubChem CID
12067446

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
18.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
22

Related reactions

1 records
New reaction record

Linked notes

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