(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol

C16H17FO3 — CID 62802132

IUPAC(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)c(C)c2)c(OC)c1
InChIInChI=1S/C16H17FO3/c1-10-8-11(4-7-14(10)17)16(18)13-6-5-12(19-2)9-15(13)20-3/h4-9,16,18H,1-3H3
InChIKeyJIQLMYWBHQTURK-UHFFFAOYSA-N
MW276.31 g/mol
LogP3.23
Rot. Bonds4

About (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol

(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol (PubChem CID 62802132) has the molecular formula C16H17FO3 and a molecular weight of 276.31 g/mol. Its IUPAC name is (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol.

Molecular Properties

Compound Name(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
PubChem CID62802132
Molecular FormulaC16H17FO3
Molecular Weight276.31 g/mol
Exact Mass276.12
IUPAC Name(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
SMILESCOc1ccc(C(O)c2ccc(F)c(C)c2)c(OC)c1
InChIInChI=1S/C16H17FO3/c1-10-8-11(4-7-14(10)17)16(18)13-6-5-12(19-2)9-15(13)20-3/h4-9,16,18H,1-3H3
InChIKeyJIQLMYWBHQTURK-UHFFFAOYSA-N
XLogP3.23
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.31
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843
(4-bromo-3,5-dimethylphenyl)-(2,4-dimethoxyphenyl)methanol
CID 114329901
(S)-(2,4-dimethoxyphenyl)-(3-methyl-4-nitrophenyl)methanol
CID 100804148
(2,4-dimethoxyphenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089367
(4-fluoro-3-methoxyphenyl)-(4-methoxyphenyl)methanol
CID 81285020
(3-bromo-4-chlorophenyl)-(2,4-dimethoxyphenyl)methanol
CID 115566318
(5-chloro-2-fluorophenyl)-(4-methoxy-3-methylphenyl)methanol
CID 61081454
(4-chloro-2-methoxyphenyl)-(3-chloro-4-methylphenyl)methanol
CID 107560197
(2-fluoro-6-methoxyphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747390
(2,4-dimethoxyphenyl)-(4-propylphenyl)methanol
CID 61087943
(3-fluoro-4-methylphenyl)-(4-methoxyphenyl)methanol
CID 60798694
(2,4-dichlorophenyl)-(2,4-dimethoxyphenyl)methanol
CID 61087695

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol?
The IUPAC name of (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol (CID 62802132) is (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol.
What is the SMILES notation for (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol?
The canonical SMILES for (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol is COc1ccc(C(O)c2ccc(F)c(C)c2)c(OC)c1.
What is the InChIKey of (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol?
The InChIKey is JIQLMYWBHQTURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO3/c1-10-8-11(4-7-14(10)17)16(18)13-6-5-12(19-2)9-15(13)20-3/h4-9,16,18H,1-3H3.
What are the key properties of (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol?
(2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol has a molecular weight of 276.31 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethoxyphenyl)-(4-fluoro-3-methylphenyl)methanol is sourced from PubChem (CID 62802132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).