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

C17H19FO2 — CID 103433209

IUPAC(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2cc(C)cc(F)c2)ccc(C)c1C
InChIInChI=1S/C17H19FO2/c1-10-7-13(9-14(18)8-10)16(19)15-6-5-11(2)12(3)17(15)20-4/h5-9,16,19H,1-4H3
InChIKeyCOMJVDMZOKEEFK-UHFFFAOYSA-N
MW274.34 g/mol
LogP3.84
Rot. Bonds3

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

(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol (PubChem CID 103433209) has the molecular formula C17H19FO2 and a molecular weight of 274.34 g/mol. Its IUPAC name is (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol.

Molecular Properties

Compound Name(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
PubChem CID103433209
Molecular FormulaC17H19FO2
Molecular Weight274.34 g/mol
Exact Mass274.14
IUPAC Name(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2cc(C)cc(F)c2)ccc(C)c1C
InChIInChI=1S/C17H19FO2/c1-10-7-13(9-14(18)8-10)16(19)15-6-5-11(2)12(3)17(15)20-4/h5-9,16,19H,1-4H3
InChIKeyCOMJVDMZOKEEFK-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

(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanamine
CID 103433807
(3,5-dibromophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 107978788
(2-methoxy-3,4-dimethylphenyl)-(2,4,6-trimethylphenyl)methanol
CID 103432508
(2-methoxy-3,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 103435788
[3-(difluoromethyl)phenyl]-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432669
(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432506
(3-fluoro-5-methylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 115823139
(2-fluoro-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103435754
(4-chloro-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823109
(4-bromo-2-methoxyphenyl)-(3-fluoro-5-methylphenyl)methanol
CID 115823095
(3-bromo-4-methoxyphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432477
(3-bromo-4-chlorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432694

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The IUPAC name of (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol (CID 103433209) is (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol.
What is the SMILES notation for (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The canonical SMILES for (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol is COc1c(C(O)c2cc(C)cc(F)c2)ccc(C)c1C.
What is the InChIKey of (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The InChIKey is COMJVDMZOKEEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FO2/c1-10-7-13(9-14(18)8-10)16(19)15-6-5-11(2)12(3)17(15)20-4/h5-9,16,19H,1-4H3.
What are the key properties of (3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)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-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol is sourced from PubChem (CID 103433209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).