2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol

C16H16F2O2 — CID 105402605

IUPAC2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol
SMILESCOCc1ccc(C(O)Cc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C16H16F2O2/c1-20-10-11-2-4-13(5-3-11)16(19)8-12-6-14(17)9-15(18)7-12/h2-7,9,16,19H,8,10H2,1H3
InChIKeyGFERKNHVCIZXQV-UHFFFAOYSA-N
MW278.30 g/mol
LogP3.39
Rot. Bonds5

About 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol

2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol (PubChem CID 105402605) has the molecular formula C16H16F2O2 and a molecular weight of 278.30 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol
PubChem CID105402605
Molecular FormulaC16H16F2O2
Molecular Weight278.30 g/mol
Exact Mass278.11
IUPAC Name2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol
SMILESCOCc1ccc(C(O)Cc2cc(F)cc(F)c2)cc1
InChIInChI=1S/C16H16F2O2/c1-20-10-11-2-4-13(5-3-11)16(19)8-12-6-14(17)9-15(18)7-12/h2-7,9,16,19H,8,10H2,1H3
InChIKeyGFERKNHVCIZXQV-UHFFFAOYSA-N
XLogP3.39
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3,5-difluorophenyl)-1-(4-propylphenyl)ethanol
CID 62800447
2,3-dihydroxy-3-[4-(methoxymethyl)phenyl]propanoic acid
CID 170823892
2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
CID 65099650
2-(1-ethylimidazol-2-yl)-1-[4-(methoxymethyl)phenyl]ethanol
CID 79744333
1-[2-(4-fluorophenyl)-2-hydroxyethyl]-3-[[4-(methoxymethyl)phenyl]methyl]urea
CID 110893336
1-[4-(methoxymethyl)phenyl]-2-(2-methyltetrazol-5-yl)ethanol
CID 107046110
1-(6-chloro-3-pyridinyl)-2-(3,5-difluorophenyl)ethanol
CID 105405774
2-(3-bromo-5-fluorophenyl)-1-(3-fluoro-4-methoxyphenyl)ethanol
CID 79702145
1-(3,4-dimethoxyphenyl)-2-(4-fluorophenyl)ethanol
CID 60797865
1-(3,5-difluorophenyl)-2-methoxyethanol
CID 62791322
2-(3-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethanol
CID 79703067
2-(3,5-difluorophenyl)-1-(1,3-dihydro-2-benzofuran-5-yl)ethanol
CID 105412803

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol?
The IUPAC name of 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol (CID 105402605) is 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol.
What is the SMILES notation for 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol?
The canonical SMILES for 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol is COCc1ccc(C(O)Cc2cc(F)cc(F)c2)cc1.
What is the InChIKey of 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol?
The InChIKey is GFERKNHVCIZXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O2/c1-20-10-11-2-4-13(5-3-11)16(19)8-12-6-14(17)9-15(18)7-12/h2-7,9,16,19H,8,10H2,1H3.
What are the key properties of 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol?
2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol has a molecular weight of 278.30 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol is sourced from PubChem (CID 105402605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).