(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol

C17H19FO2 — CID 61081867

IUPAC(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCOc1ccc(C(O)c2c(C)cc(C)cc2C)cc1F
InChIInChI=1S/C17H19FO2/c1-10-7-11(2)16(12(3)8-10)17(19)13-5-6-15(20-4)14(18)9-13/h5-9,17,19H,1-4H3
InChIKeyICLZXVKXBUNADX-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.84
Rot. Bonds3

About (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol

(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol (PubChem CID 61081867) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol.

Molecular Properties

Compound Name(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol
PubChem CID61081867
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol
SMILESCOc1ccc(C(O)c2c(C)cc(C)cc2C)cc1F
InChIInChI=1S/C17H19FO2/c1-10-7-11(2)16(12(3)8-10)17(19)13-5-6-15(20-4)14(18)9-13/h5-9,17,19H,1-4H3
InChIKeyICLZXVKXBUNADX-UHFFFAOYSA-N
XLogP3.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,6-difluoro-3-methylphenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 82816107
(2,6-dimethoxyphenyl)-(3-fluoro-4-methylphenyl)methanol
CID 116809700
(5-bromo-2-methylphenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 65307087
(3-chloro-4-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 63094497
(3-fluoro-4-methoxyphenyl)-pyrimidin-2-ylmethanol
CID 62795072
(3-bromo-4-methylphenyl)-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679797
(3-fluoro-4-methoxyphenyl)-(5-methylthiophen-3-yl)methanol
CID 65099686
(4-fluoro-2,6-dimethylphenyl)-(3-fluoro-4-methoxyphenyl)methanamine
CID 106877521
(3-fluoro-4-methoxyphenyl)-(3,4,5-trimethyl-1H-pyrrol-2-yl)methanol
CID 63927912
(4-bromo-2-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61082273
(2-fluoro-6-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747390
(2,4-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61083249

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol?
The IUPAC name of (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol (CID 61081867) is (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol.
What is the SMILES notation for (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol?
The canonical SMILES for (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol is COc1ccc(C(O)c2c(C)cc(C)cc2C)cc1F.
What is the InChIKey of (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol?
The InChIKey is ICLZXVKXBUNADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-10-7-11(2)16(12(3)8-10)17(19)13-5-6-15(20-4)14(18)9-13/h5-9,17,19H,1-4H3.
What are the key properties of (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol?
(3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol has a molecular weight of 274.34 g/mol, XLogP of 3.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-methoxyphenyl)-(2,4,6-trimethylphenyl)methanol is sourced from PubChem (CID 61081867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).