1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene

C20H17FO — CID 132919259

IUPAC1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene
SMILESCOc1ccc(C(c2ccccc2)c2ccc(F)cc2)cc1
InChIInChI=1S/C20H17FO/c1-22-19-13-9-17(10-14-19)20(15-5-3-2-4-6-15)16-7-11-18(21)12-8-16/h2-14,20H,1H3
InChIKeyRISLUYVQYLRAGQ-UHFFFAOYSA-N
MW292.35 g/mol
LogP5.01
Rot. Bonds4

About 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene

1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene (PubChem CID 132919259) has the molecular formula C20H17FO and a molecular weight of 292.35 g/mol. Its IUPAC name is 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene
PubChem CID132919259
Molecular FormulaC20H17FO
Molecular Weight292.35 g/mol
Exact Mass292.13
IUPAC Name1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene
SMILESCOc1ccc(C(c2ccccc2)c2ccc(F)cc2)cc1
InChIInChI=1S/C20H17FO/c1-22-19-13-9-17(10-14-19)20(15-5-3-2-4-6-15)16-7-11-18(21)12-8-16/h2-14,20H,1H3
InChIKeyRISLUYVQYLRAGQ-UHFFFAOYSA-N
XLogP5.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.35
LogP ≤ 55.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

1-[bis[4-[(4-methoxyphenyl)-phenylmethyl]phenyl]methyl]-4-methoxybenzene
CID 70877905
1-[bis(4-methoxyphenyl)methyl]-4-phenylbenzene
CID 134976312
1-tert-butyl-4-[(4-methoxyphenyl)-phenylmethyl]benzene
CID 102293623
2-(4-fluorophenyl)-2-(4-methoxyphenyl)ethanamine
CID 82023270
[4-[bis(4-methoxyphenyl)methyl]phenyl]-diphenylphosphane
CID 132574561
1-methoxy-2-[[4-[(4-methoxyphenyl)-phenylmethyl]phenyl]-diphenylmethyl]benzene
CID 123600060
4-[(4-methoxyphenyl)-phenylmethyl]-2-methylphenol
CID 10804464
difluoromethane;1-fluoro-4-methoxybenzene
CID 157211198
1-[(4-methoxyphenyl)-phenylmethyl]naphthalene
CID 19697043
N-[(4-fluorophenyl)-phenylmethyl]-2-(4-methoxyphenoxy)acetamide
CID 55583125
(3S)-3-(4-fluorophenyl)-3-(4-methoxyphenyl)propanoate
CID 2038667
1-methoxy-4-[(1R)-1-phenylprop-2-enyl]benzene
CID 102287060

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene?
The IUPAC name of 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene (CID 132919259) is 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene.
What is the SMILES notation for 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene?
The canonical SMILES for 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene is COc1ccc(C(c2ccccc2)c2ccc(F)cc2)cc1.
What is the InChIKey of 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene?
The InChIKey is RISLUYVQYLRAGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17FO/c1-22-19-13-9-17(10-14-19)20(15-5-3-2-4-6-15)16-7-11-18(21)12-8-16/h2-14,20H,1H3.
What are the key properties of 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene?
1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene has a molecular weight of 292.35 g/mol, XLogP of 5.01, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[(4-methoxyphenyl)-phenylmethyl]benzene is sourced from PubChem (CID 132919259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).