1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol

C17H18F2O2 — CID 63894999

IUPAC1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol
SMILESCc1cc(C)cc(CC(O)c2ccccc2OC(F)F)c1
InChIInChI=1S/C17H18F2O2/c1-11-7-12(2)9-13(8-11)10-15(20)14-5-3-4-6-16(14)21-17(18)19/h3-9,15,17,20H,10H2,1-2H3
InChIKeyMFPJDYDDZUXHMX-UHFFFAOYSA-N
MW292.32 g/mol
LogP4.18
Rot. Bonds5

About 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol

1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol (PubChem CID 63894999) has the molecular formula C17H18F2O2 and a molecular weight of 292.32 g/mol. Its IUPAC name is 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol.

Molecular Properties

Compound Name1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol
PubChem CID63894999
Molecular FormulaC17H18F2O2
Molecular Weight292.32 g/mol
Exact Mass292.13
IUPAC Name1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol
SMILESCc1cc(C)cc(CC(O)c2ccccc2OC(F)F)c1
InChIInChI=1S/C17H18F2O2/c1-11-7-12(2)9-13(8-11)10-15(20)14-5-3-4-6-16(14)21-17(18)19/h3-9,15,17,20H,10H2,1-2H3
InChIKeyMFPJDYDDZUXHMX-UHFFFAOYSA-N
XLogP4.18
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.32
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(difluoromethoxy)phenyl]-2-(3-methylphenyl)ethanol
CID 63017552
(1S)-1-[2-(difluoromethoxy)phenyl]propan-1-ol
CID 78930737
1-[2-(difluoromethoxy)phenyl]-3-methylbutan-1-ol
CID 63893645
1-[2-(difluoromethoxy)phenyl]-5-methylhexan-1-ol
CID 83158841
1-[3-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol
CID 114980286
2-(3,5-dimethylphenyl)-1-(2-ethylphenyl)ethanol
CID 63899918
1-[2-(difluoromethoxy)phenyl]-4-phenylbutan-1-ol
CID 65150664
(1R,2S)-1-amino-1-[2-(difluoromethoxy)phenyl]butan-2-ol
CID 171264497
[2-(difluoromethoxy)phenyl]-(3-methylphenyl)methanol
CID 63895753
1-(2-methoxyphenyl)-2-(4-methylphenyl)ethanol
CID 15638774
[2-(difluoromethoxy)phenyl]-(2-methoxy-5-methylphenyl)methanol
CID 61081501
1-[2-(difluoromethoxy)phenyl]-2-methylpropan-1-ol
CID 63894804

Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol?
The IUPAC name of 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol (CID 63894999) is 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol.
What is the SMILES notation for 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol?
The canonical SMILES for 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol is Cc1cc(C)cc(CC(O)c2ccccc2OC(F)F)c1.
What is the InChIKey of 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol?
The InChIKey is MFPJDYDDZUXHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18F2O2/c1-11-7-12(2)9-13(8-11)10-15(20)14-5-3-4-6-16(14)21-17(18)19/h3-9,15,17,20H,10H2,1-2H3.
What are the key properties of 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol?
1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol has a molecular weight of 292.32 g/mol, XLogP of 4.18, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethoxy)phenyl]-2-(3,5-dimethylphenyl)ethanol is sourced from PubChem (CID 63894999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).