(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol

C16H17FO2 — CID 61086897

IUPAC(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol
SMILESCOc1ccc(F)cc1C(O)c1ccc(C)cc1C
InChIInChI=1S/C16H17FO2/c1-10-4-6-13(11(2)8-10)16(18)14-9-12(17)5-7-15(14)19-3/h4-9,16,18H,1-3H3
InChIKeyKGCDFMDQGPZCOG-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.53
Rot. Bonds3

About (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol

(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol (PubChem CID 61086897) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol.

Molecular Properties

Compound Name(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol
PubChem CID61086897
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol
SMILESCOc1ccc(F)cc1C(O)c1ccc(C)cc1C
InChIInChI=1S/C16H17FO2/c1-10-4-6-13(11(2)8-10)16(18)14-9-12(17)5-7-15(14)19-3/h4-9,16,18H,1-3H3
InChIKeyKGCDFMDQGPZCOG-UHFFFAOYSA-N
XLogP3.53
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-fluoro-2-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 63899302
(2-bromo-5-methylphenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 81111399
(2-chloro-4-fluorophenyl)-(2-methoxy-5-methylphenyl)methanol
CID 61080374
1-(2,4-dimethylphenyl)-1-(5-fluoro-2-methoxyphenyl)-N-methylmethanamine
CID 43485698
(2-amino-5-fluorophenyl)-(2,4-dimethylphenyl)methanol
CID 82684351
(2-fluoro-5-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 62509628
bis(4-fluoro-2-methylphenyl)methanol
CID 14371387
(5-fluoro-2-methoxyphenyl)-(5-methyl-2-pyridinyl)methanol
CID 82770681
(4-bromo-2-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanol
CID 115794081
(5-chloro-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 61087442
(2,4-dimethylphenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61080731
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanol
CID 62791480

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol?
The IUPAC name of (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol (CID 61086897) is (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol.
What is the SMILES notation for (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol?
The canonical SMILES for (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol is COc1ccc(F)cc1C(O)c1ccc(C)cc1C.
What is the InChIKey of (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol?
The InChIKey is KGCDFMDQGPZCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-10-4-6-13(11(2)8-10)16(18)14-9-12(17)5-7-15(14)19-3/h4-9,16,18H,1-3H3.
What are the key properties of (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol?
(2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol has a molecular weight of 260.31 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethylphenyl)-(5-fluoro-2-methoxyphenyl)methanol is sourced from PubChem (CID 61086897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).