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

C15H14F2O2 — CID 123795943

IUPAC2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene
SMILESCOc1ccc(OCc2ccc(C)cc2)c(F)c1F
InChIInChI=1S/C15H14F2O2/c1-10-3-5-11(6-4-10)9-19-13-8-7-12(18-2)14(16)15(13)17/h3-8H,9H2,1-2H3
InChIKeyDBDATFGZFKBCCF-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.86
Rot. Bonds4

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

2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene (PubChem CID 123795943) has the molecular formula C15H14F2O2 and a molecular weight of 264.27 g/mol. Its IUPAC name is 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene.

Molecular Properties

Compound Name2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene
PubChem CID123795943
Molecular FormulaC15H14F2O2
Molecular Weight264.27 g/mol
Exact Mass264.10
IUPAC Name2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene
SMILESCOc1ccc(OCc2ccc(C)cc2)c(F)c1F
InChIInChI=1S/C15H14F2O2/c1-10-3-5-11(6-4-10)9-19-13-8-7-12(18-2)14(16)15(13)17/h3-8H,9H2,1-2H3
InChIKeyDBDATFGZFKBCCF-UHFFFAOYSA-N
XLogP3.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-fluorophenyl)-N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]methanamine
CID 4719742
2,3-difluoro-1-methyl-4-phenylmethoxybenzene
CID 57470603
1-[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]propan-1-one
CID 83950881
[5-fluoro-2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 107698416
2-methoxy-4-[2-(4-methoxyphenyl)ethyl]-1-[(4-methylphenyl)methoxy]benzene
CID 157158831
4-methoxy-3-[(4-methylphenyl)methoxy]benzenecarbothioamide
CID 22681441
4-bromo-2-fluoro-1-[(4-methylphenyl)methoxy]benzene
CID 146003862
1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
CID 957472
3-[4-methoxy-3-[(4-methylphenyl)methoxy]phenyl]propan-1-amine
CID 82186047
2-fluoro-1-methoxy-3-methylsulfanyl-4-phenylmethoxybenzene
CID 164893709
N-[[3-methoxy-4-[(4-methylphenyl)methoxy]phenyl]methyl]propan-2-amine
CID 17156148
2,3-difluoro-1-propoxy-4-[(4-propylphenyl)methoxy]benzene
CID 145339803

Frequently Asked Questions

What is the IUPAC name of 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene?
The IUPAC name of 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene (CID 123795943) is 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene.
What is the SMILES notation for 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene?
The canonical SMILES for 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene is COc1ccc(OCc2ccc(C)cc2)c(F)c1F.
What is the InChIKey of 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene?
The InChIKey is DBDATFGZFKBCCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O2/c1-10-3-5-11(6-4-10)9-19-13-8-7-12(18-2)14(16)15(13)17/h3-8H,9H2,1-2H3.
What are the key properties of 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene?
2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene has a molecular weight of 264.27 g/mol, XLogP of 3.86, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-difluoro-1-methoxy-4-[(4-methylphenyl)methoxy]benzene is sourced from PubChem (CID 123795943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).