2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene

C19H22F2O2 — CID 145339803

IUPAC2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene
SMILESCCCOc1ccc(OCc2ccc(CCC)cc2)c(F)c1F
InChIInChI=1S/C19H22F2O2/c1-3-5-14-6-8-15(9-7-14)13-23-17-11-10-16(22-12-4-2)18(20)19(17)21/h6-11H,3-5,12-13H2,1-2H3
InChIKeyLJQMMWZCXKIURY-UHFFFAOYSA-N
MW320.38 g/mol
LogP5.29
Rot. Bonds8

About 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene

2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene (PubChem CID 145339803) has the molecular formula C19H22F2O2 and a molecular weight of 320.38 g/mol. Its IUPAC name is 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene.

Molecular Properties

Compound Name2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene
PubChem CID145339803
Molecular FormulaC19H22F2O2
Molecular Weight320.38 g/mol
Exact Mass320.16
IUPAC Name2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene
SMILESCCCOc1ccc(OCc2ccc(CCC)cc2)c(F)c1F
InChIInChI=1S/C19H22F2O2/c1-3-5-14-6-8-15(9-7-14)13-23-17-11-10-16(22-12-4-2)18(20)19(17)21/h6-11H,3-5,12-13H2,1-2H3
InChIKeyLJQMMWZCXKIURY-UHFFFAOYSA-N
XLogP5.29
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.38
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,3-difluoro-4-[(4-pentylphenyl)methoxy]benzonitrile
CID 23051969
2,3-difluoro-1-propoxy-4-[4-[(E)-2-[4-(4-propylphenyl)cyclohexyl]ethenyl]cyclohexyl]benzene
CID 154607073
2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene
CID 123795943
1-[[4-(4-butoxy-2-fluorophenyl)phenyl]methoxy]-2,3-difluoro-4-(4-propoxyphenyl)benzene
CID 89429715
2,3-difluoro-1,4-dihexoxybenzene
CID 125465685
2,3-difluoro-1-[2-(4-heptylphenyl)ethynyl]-4-propoxybenzene
CID 67865423
[4-[(2-propoxyphenoxy)methyl]phenyl]methanol
CID 115969538
2-chloro-1-propoxy-4-propylbenzene;ethane
CID 143012036
1-(2,3-difluoro-4-hexoxyphenyl)-2,3-difluoro-4-propoxybenzene
CID 125478760
2,3-difluoro-1-propoxy-4-[4-[4-[4-(4-propylphenyl)phenyl]but-1-enyl]cyclohexyl]benzene
CID 77417265
2,3-difluoro-1-[2-[4-(4-hexylphenyl)phenyl]ethynyl]-4-propoxybenzene
CID 67864649
2,3-difluoro-1-methyl-4-phenylmethoxybenzene
CID 57470603

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene?
The IUPAC name of 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene (CID 145339803) is 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene.
What is the SMILES notation for 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene?
The canonical SMILES for 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene is CCCOc1ccc(OCc2ccc(CCC)cc2)c(F)c1F.
What is the InChIKey of 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene?
The InChIKey is LJQMMWZCXKIURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22F2O2/c1-3-5-14-6-8-15(9-7-14)13-23-17-11-10-16(22-12-4-2)18(20)19(17)21/h6-11H,3-5,12-13H2,1-2H3.
What are the key properties of 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene?
2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene has a molecular weight of 320.38 g/mol, XLogP of 5.29, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene is sourced from PubChem (CID 145339803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).