[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol

C17H19FO2 — CID 105372055

IUPAC[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol
SMILESCc1ccc(F)cc1COc1c(C)cc(CO)cc1C
InChIInChI=1S/C17H19FO2/c1-11-4-5-16(18)8-15(11)10-20-17-12(2)6-14(9-19)7-13(17)3/h4-8,19H,9-10H2,1-3H3
InChIKeyBWTMXYOSXBTVMN-UHFFFAOYSA-N
MW274.33 g/mol
LogP3.82
Rot. Bonds4

About [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol

[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol (PubChem CID 105372055) has the molecular formula C17H19FO2 and a molecular weight of 274.33 g/mol. Its IUPAC name is [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol.

Molecular Properties

Compound Name[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol
PubChem CID105372055
Molecular FormulaC17H19FO2
Molecular Weight274.33 g/mol
Exact Mass274.14
IUPAC Name[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol
SMILESCc1ccc(F)cc1COc1c(C)cc(CO)cc1C
InChIInChI=1S/C17H19FO2/c1-11-4-5-16(18)8-15(11)10-20-17-12(2)6-14(9-19)7-13(17)3/h4-8,19H,9-10H2,1-3H3
InChIKeyBWTMXYOSXBTVMN-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

[3-chloro-4-[(5-fluoro-2-methylphenyl)methoxy]-5-methoxyphenyl]methanol
CID 105372054
[4-[(2-fluorophenyl)methoxy]-3,5-dimethylphenyl]methanol
CID 28933284
[3-fluoro-4-[(5-fluoro-2-methylphenyl)methoxy]phenyl]methanol
CID 107690953
[4-[(3,5-difluorophenyl)methoxy]-3,5-dimethylphenyl]methanol
CID 105404106
1,3-dibromo-5-(chloromethyl)-2-[(5-fluoro-2-methylphenyl)methoxy]benzene
CID 107745450
5-(bromomethyl)-2-[(2,5-difluorophenyl)methoxy]-1,3-dimethylbenzene
CID 63535162
[3-ethoxy-4-[(5-fluoro-2-methylphenyl)methoxy]phenyl]methanol
CID 105372050
[4-[(3,4-dimethylphenyl)methoxy]-3,5-difluorophenyl]methanol
CID 79888635
[2-[(2,5-dimethylphenyl)methoxy]-5-fluorophenyl]methanol
CID 107698577
4-fluoro-3-[[4-(hydroxymethyl)-2,6-dimethylphenoxy]methyl]benzonitrile
CID 28933257
2-[[4-(chloromethyl)-2,6-dimethylphenoxy]methyl]-4-fluorobenzonitrile
CID 107906212
5-(chloromethyl)-2-[(2,5-dimethylphenyl)methoxy]-1,3-dimethylbenzene
CID 63535326

Frequently Asked Questions

What is the IUPAC name of [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol?
The IUPAC name of [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol (CID 105372055) is [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol.
What is the SMILES notation for [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol?
The canonical SMILES for [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol is Cc1ccc(F)cc1COc1c(C)cc(CO)cc1C.
What is the InChIKey of [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol?
The InChIKey is BWTMXYOSXBTVMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-11-4-5-16(18)8-15(11)10-20-17-12(2)6-14(9-19)7-13(17)3/h4-8,19H,9-10H2,1-3H3.
What are the key properties of [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol?
[4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]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 [4-[(5-fluoro-2-methylphenyl)methoxy]-3,5-dimethylphenyl]methanol is sourced from PubChem (CID 105372055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).