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2,4-Dichloro-6'-fluoro-2'-methoxy-biphenyl

HCID 69117451
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1cccc(F)c1-c1ccc(Cl)cc1Cl
InChIKey
XNYMROPOSUWCNS-UHFFFAOYSA-N
Molecular formula
C13H9Cl2FO
Average molar mass
271.11 g/mol

Names & identifiers

Preferred name
2,4-Dichloro-6'-fluoro-2'-methoxy-biphenyl
IUPAC
2,4-dichloro-1-(2-fluoro-6-methoxyphenyl)benzene

Names & synonyms

2,4-Dichloro-6'-fluoro-2'-methoxy-biphenyl913629-17-1SCHEMBL4621308XNYMROPOSUWCNS-UHFFFAOYSA-N2,4-dichloro-2'-fluoro-6'-methoxybiphenyl

Database identifiers

PubChem CID
69117451

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
9.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
252

Related reactions

4 records
New reaction record
HRID 189822 reaction equation
HRID 189822As productTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 902379 reaction equation
HRID 902379As productuspto-grants-2008_04
HRID 902380 reaction equation
HRID 902380As reactantuspto-grants-2008_04
HRID 2336611 reaction equation
HRID 2336611As reactantTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes