[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol

C17H19FO2 — CID 107698387

IUPAC[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
SMILESCc1cc(C)c(COc2ccc(F)cc2CO)c(C)c1
InChIInChI=1S/C17H19FO2/c1-11-6-12(2)16(13(3)7-11)10-20-17-5-4-15(18)8-14(17)9-19/h4-8,19H,9-10H2,1-3H3
InChIKeyIZGYCSJXLWACKF-UHFFFAOYSA-N
MW274.33 g/mol
LogP3.82
Rot. Bonds4

About [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol

[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol (PubChem CID 107698387) has the molecular formula C17H19FO2 and a molecular weight of 274.33 g/mol. Its IUPAC name is [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
PubChem CID107698387
Molecular FormulaC17H19FO2
Molecular Weight274.33 g/mol
Exact Mass274.14
IUPAC Name[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
SMILESCc1cc(C)c(COc2ccc(F)cc2CO)c(C)c1
InChIInChI=1S/C17H19FO2/c1-11-6-12(2)16(13(3)7-11)10-20-17-5-4-15(18)8-14(17)9-19/h4-8,19H,9-10H2,1-3H3
InChIKeyIZGYCSJXLWACKF-UHFFFAOYSA-N
XLogP3.82
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.33
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanamine
CID 107694762
[5-bromo-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
CID 63533092
[2-[(2,5-dimethylphenyl)methoxy]-5-fluorophenyl]methanol
CID 107698577
[5-fluoro-2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 107698416
[5-fluoro-2-[(2-methylphenyl)methoxy]phenyl]methanol
CID 107698567
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-methylphenyl]methanol
CID 102616489
[3-methoxy-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
CID 62550020
N-[[2-[(2,6-dimethylphenyl)methoxy]-5-fluorophenyl]methyl]ethanamine
CID 107695600
2-[2-[(2,4,6-trimethylphenyl)methoxy]phenyl]acetic acid
CID 80722666
1-[2-[(2,6-dimethylphenyl)methoxy]-5-fluorophenyl]propan-2-amine
CID 107701121
(5-fluoro-2-hexoxyphenyl)methanol
CID 91657337
[2-[2-(dimethylamino)ethoxy]-5-fluorophenyl]methanol
CID 107698691

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol?
The IUPAC name of [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol (CID 107698387) is [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol?
The canonical SMILES for [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol is Cc1cc(C)c(COc2ccc(F)cc2CO)c(C)c1.
What is the InChIKey of [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol?
The InChIKey is IZGYCSJXLWACKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-11-6-12(2)16(13(3)7-11)10-20-17-5-4-15(18)8-14(17)9-19/h4-8,19H,9-10H2,1-3H3.
What are the key properties of [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol?
[5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol has a molecular weight of 274.33 g/mol, XLogP of 3.82, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 107698387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).