(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol

C16H17FO2 — CID 115827523

IUPAC(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol
SMILESCCOc1cccc(C(O)c2ccc(C)cc2F)c1
InChIInChI=1S/C16H17FO2/c1-3-19-13-6-4-5-12(10-13)16(18)14-8-7-11(2)9-15(14)17/h4-10,16,18H,3H2,1-2H3
InChIKeyISSBZDOTHAXBRF-UHFFFAOYSA-N
MW260.31 g/mol
LogP3.61
Rot. Bonds4

About (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol

(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol (PubChem CID 115827523) has the molecular formula C16H17FO2 and a molecular weight of 260.31 g/mol. Its IUPAC name is (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol
PubChem CID115827523
Molecular FormulaC16H17FO2
Molecular Weight260.31 g/mol
Exact Mass260.12
IUPAC Name(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol
SMILESCCOc1cccc(C(O)c2ccc(C)cc2F)c1
InChIInChI=1S/C16H17FO2/c1-3-19-13-6-4-5-12(10-13)16(18)14-8-7-11(2)9-15(14)17/h4-10,16,18H,3H2,1-2H3
InChIKeyISSBZDOTHAXBRF-UHFFFAOYSA-N
XLogP3.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.31
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-dimethylphenyl)-(3-ethoxyphenyl)methanol
CID 62802337
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(2-fluoro-4-methylphenyl)-naphthalen-2-ylmethanol
CID 115792718
(2-fluoro-4-methylphenyl)-(5-propoxy-3-pyridinyl)methanol
CID 115829147
(2-ethoxy-5-methylphenyl)-(3-fluorophenyl)methanol
CID 62301823
chloro-(3-ethoxyphenyl)methanol
CID 141156919
(3-ethoxyphenyl)-(2,4,5-trimethylfuran-3-yl)methanol
CID 115827546
(5-ethoxy-3-pyridinyl)-(2-fluoro-5-methylphenyl)methanol
CID 115828977
(3-ethoxyphenyl)-(3-methylphenyl)methanamine
CID 60798038
(3-ethoxyphenyl)-(3-methylthiophen-2-yl)methanol
CID 79992255
(4-cyclopropyloxyphenyl)-(2-fluoro-4-methylphenyl)methanol
CID 115838353
3-amino-1-(3-ethoxyphenyl)propan-1-ol
CID 79135598

Frequently Asked Questions

What is the IUPAC name of (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol?
The IUPAC name of (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol (CID 115827523) is (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol.
What is the SMILES notation for (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol?
The canonical SMILES for (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol is CCOc1cccc(C(O)c2ccc(C)cc2F)c1.
What is the InChIKey of (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol?
The InChIKey is ISSBZDOTHAXBRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO2/c1-3-19-13-6-4-5-12(10-13)16(18)14-8-7-11(2)9-15(14)17/h4-10,16,18H,3H2,1-2H3.
What are the key properties of (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol?
(3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol has a molecular weight of 260.31 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-ethoxyphenyl)-(2-fluoro-4-methylphenyl)methanol is sourced from PubChem (CID 115827523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).