(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol

C16H16F2O2 — CID 107512126

IUPAC(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)c1ccc(C)c(F)c1F
InChIInChI=1S/C16H16F2O2/c1-3-20-13-7-5-4-6-11(13)16(19)12-9-8-10(2)14(17)15(12)18/h4-9,16,19H,3H2,1-2H3
InChIKeyYJHYOMBJHGQABD-UHFFFAOYSA-N
MW278.30 g/mol
LogP3.75
Rot. Bonds4

About (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol

(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol (PubChem CID 107512126) has the molecular formula C16H16F2O2 and a molecular weight of 278.30 g/mol. Its IUPAC name is (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol.

Molecular Properties

Compound Name(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol
PubChem CID107512126
Molecular FormulaC16H16F2O2
Molecular Weight278.30 g/mol
Exact Mass278.11
IUPAC Name(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)c1ccc(C)c(F)c1F
InChIInChI=1S/C16H16F2O2/c1-3-20-13-7-5-4-6-11(13)16(19)12-9-8-10(2)14(17)15(12)18/h4-9,16,19H,3H2,1-2H3
InChIKeyYJHYOMBJHGQABD-UHFFFAOYSA-N
XLogP3.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethoxyphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63893443
(2-ethoxyphenyl)-(2-ethylphenyl)methanol
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(2-chlorophenyl)-(2-ethoxyphenyl)methanol
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(2,4-dibromophenyl)-(2-ethoxyphenyl)methanol
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(2-ethoxyphenyl)-(5-fluoro-2-pyridinyl)methanol
CID 79721579
(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanol
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(2-ethoxy-5-methylphenyl)-(2-methylphenyl)methanol
CID 62302666
(4-ethoxyphenyl)-(2-fluoro-3-methylphenyl)methanol
CID 81477516
(3-chloro-2-fluorophenyl)-(2-ethoxy-5-methylphenyl)methanol
CID 81266896
(5-bromo-4-fluoro-2-methoxyphenyl)-(2-ethoxyphenyl)methanol
CID 103396097
(4-chloro-3-methylphenyl)-(2-ethoxyphenyl)methanol
CID 115795759
1-ethoxy-2-fluoro-3-methylbenzene
CID 59732440

Frequently Asked Questions

What is the IUPAC name of (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol?
The IUPAC name of (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol (CID 107512126) is (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol.
What is the SMILES notation for (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol?
The canonical SMILES for (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol is CCOc1ccccc1C(O)c1ccc(C)c(F)c1F.
What is the InChIKey of (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol?
The InChIKey is YJHYOMBJHGQABD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O2/c1-3-20-13-7-5-4-6-11(13)16(19)12-9-8-10(2)14(17)15(12)18/h4-9,16,19H,3H2,1-2H3.
What are the key properties of (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol?
(2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol has a molecular weight of 278.30 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-difluoro-4-methylphenyl)-(2-ethoxyphenyl)methanol is sourced from PubChem (CID 107512126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).