2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene

C15H13Cl2FO2 — CID 57170883

IUPAC2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene
SMILESCC(COc1ccc(Cl)cc1Cl)Oc1ccc(F)cc1
InChIInChI=1S/C15H13Cl2FO2/c1-10(20-13-5-3-12(18)4-6-13)9-19-15-7-2-11(16)8-14(15)17/h2-8,10H,9H2,1H3
InChIKeyJOXJRLIRXSYQDI-UHFFFAOYSA-N
MW315.17 g/mol
LogP4.98
Rot. Bonds5

About 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene

2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene (PubChem CID 57170883) has the molecular formula C15H13Cl2FO2 and a molecular weight of 315.17 g/mol. Its IUPAC name is 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene.

Molecular Properties

Compound Name2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene
PubChem CID57170883
Molecular FormulaC15H13Cl2FO2
Molecular Weight315.17 g/mol
Exact Mass314.03
IUPAC Name2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene
SMILESCC(COc1ccc(Cl)cc1Cl)Oc1ccc(F)cc1
InChIInChI=1S/C15H13Cl2FO2/c1-10(20-13-5-3-12(18)4-6-13)9-19-15-7-2-11(16)8-14(15)17/h2-8,10H,9H2,1H3
InChIKeyJOXJRLIRXSYQDI-UHFFFAOYSA-N
XLogP4.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.17
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N'-[2-(2,4-dichlorophenoxy)propanoyl]-2-(4-fluorophenoxy)propanehydrazide
CID 43004127
2,4-dichloro-1-(2,2-difluoroethoxy)benzene
CID 57262164
2-[4-(2,4-dichlorophenoxy)phenoxy]propan-1-ol
CID 12804883
1-(2-chloro-4-fluorophenoxy)propan-2-ol
CID 65277724
1-(2,4-dichlorophenoxy)-3-(4-fluoroanilino)propan-2-ol
CID 60898363
1-(2,4-dichlorophenoxy)-3-[(4-fluorophenyl)methylamino]propan-2-ol
CID 168510550
2-chloro-1-[(4-chlorophenoxy)methoxy]-4-fluorobenzene
CID 56627522
methyl 3-(2,4-dichlorophenoxy)-2-phenoxypropanoate
CID 70632599
4-chloro-2-(chloromethyl)-1-(4-fluorophenoxy)benzene
CID 114846972
1-(4-chloro-2-fluorophenoxy)propan-2-amine
CID 83396709
1-(2-chloro-4-fluorophenoxy)-3-propan-2-yloxypropan-2-ol
CID 71943765
(2R)-1-(2-chloro-4-fluorophenoxy)-3-propan-2-yloxypropan-2-ol
CID 97085392

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene?
The IUPAC name of 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene (CID 57170883) is 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene.
What is the SMILES notation for 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene?
The canonical SMILES for 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene is CC(COc1ccc(Cl)cc1Cl)Oc1ccc(F)cc1.
What is the InChIKey of 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene?
The InChIKey is JOXJRLIRXSYQDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FO2/c1-10(20-13-5-3-12(18)4-6-13)9-19-15-7-2-11(16)8-14(15)17/h2-8,10H,9H2,1H3.
What are the key properties of 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene?
2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene has a molecular weight of 315.17 g/mol, XLogP of 4.98, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-1-[2-(4-fluorophenoxy)propoxy]benzene is sourced from PubChem (CID 57170883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).