1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol

C17H20O2 — CID 116756761

IUPAC1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol
SMILESCOC(c1ccccc1)C(O)c1ccc(C)cc1C
InChIInChI=1S/C17H20O2/c1-12-9-10-15(13(2)11-12)16(18)17(19-3)14-7-5-4-6-8-14/h4-11,16-18H,1-3H3
InChIKeyLDVHTDOOKUPDHA-UHFFFAOYSA-N
MW256.34 g/mol
LogP3.72
Rot. Bonds4

About 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol

1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol (PubChem CID 116756761) has the molecular formula C17H20O2 and a molecular weight of 256.34 g/mol. Its IUPAC name is 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol.

Molecular Properties

Compound Name1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol
PubChem CID116756761
Molecular FormulaC17H20O2
Molecular Weight256.34 g/mol
Exact Mass256.15
IUPAC Name1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol
SMILESCOC(c1ccccc1)C(O)c1ccc(C)cc1C
InChIInChI=1S/C17H20O2/c1-12-9-10-15(13(2)11-12)16(18)17(19-3)14-7-5-4-6-8-14/h4-11,16-18H,1-3H3
InChIKeyLDVHTDOOKUPDHA-UHFFFAOYSA-N
XLogP3.72
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.34
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,4-dimethylphenyl)-phenylmethanol
CID 3807153
2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
CID 106680320
2-methoxy-1-(2-methoxy-3,4-dimethylphenyl)-2-phenylethanol
CID 103433262
1-(2-fluoro-4,6-dimethylphenyl)-2-methoxy-2-phenylethanol
CID 106881196
1-(2,4-dimethylphenyl)-2-methoxy-3-methylbutan-1-ol
CID 116711931
1-(3-fluoro-5-methylphenyl)-2-methoxy-2-phenylethanol
CID 116756883
2,4-dimethyl-1-[(4-methylphenyl)-phenylmethyl]benzene
CID 22389703
1-(2-ethoxyphenyl)-2-methoxy-2-phenylethanol
CID 116757008
2-ethoxy-2-phenyl-1-(2,4,5-trimethylphenyl)ethanol
CID 116757043
2-methoxy-1-(2-methoxy-5-methylphenyl)-2-phenylethanamine
CID 116772779
3-(3,5-dimethylphenyl)-1-methoxy-1-phenylpropan-2-ol
CID 116757000
1-(3,4-difluorophenyl)-2-methoxy-2-phenylethanol
CID 116756981

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol?
The IUPAC name of 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol (CID 116756761) is 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol.
What is the SMILES notation for 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol?
The canonical SMILES for 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol is COC(c1ccccc1)C(O)c1ccc(C)cc1C.
What is the InChIKey of 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol?
The InChIKey is LDVHTDOOKUPDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O2/c1-12-9-10-15(13(2)11-12)16(18)17(19-3)14-7-5-4-6-8-14/h4-11,16-18H,1-3H3.
What are the key properties of 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol?
1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol has a molecular weight of 256.34 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylphenyl)-2-methoxy-2-phenylethanol is sourced from PubChem (CID 116756761), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).