(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol

C16H16F2O2 — CID 61099736

IUPAC(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
SMILESCOCCc1ccc(C(O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C16H16F2O2/c1-20-9-8-11-2-4-12(5-3-11)16(19)13-6-7-14(17)15(18)10-13/h2-7,10,16,19H,8-9H2,1H3
InChIKeyJYTOYDRNFWYWQM-UHFFFAOYSA-N
MW278.30 g/mol
LogP3.24
Rot. Bonds5

About (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol

(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol (PubChem CID 61099736) has the molecular formula C16H16F2O2 and a molecular weight of 278.30 g/mol. Its IUPAC name is (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol.

Molecular Properties

Compound Name(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
PubChem CID61099736
Molecular FormulaC16H16F2O2
Molecular Weight278.30 g/mol
Exact Mass278.11
IUPAC Name(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
SMILESCOCCc1ccc(C(O)c2ccc(F)c(F)c2)cc1
InChIInChI=1S/C16H16F2O2/c1-20-9-8-11-2-4-12(5-3-11)16(19)13-6-7-14(17)15(18)10-13/h2-7,10,16,19H,8-9H2,1H3
InChIKeyJYTOYDRNFWYWQM-UHFFFAOYSA-N
XLogP3.24
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 ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chlorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 55133393
(5-chloro-2-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099907
(2,6-difluoro-3-methylphenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 82799843
1,2-difluoro-4-(2-methoxyethyl)benzene
CID 18372069
(2-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099399
(2,4-dichlorophenyl)-[4-(2-methoxyethyl)phenyl]methanol
CID 61099046
(1R)-1-[3-fluoro-4-[4-(2-methoxyethyl)phenoxy]phenyl]ethanol
CID 63372547
4-[bromo-[4-(2-methoxyethyl)phenyl]methyl]-1-fluoro-2-methoxybenzene
CID 81289235
2,2-difluoro-1-[4-(2-methoxyethyl)phenyl]ethanol
CID 104632700
[4-(2-methoxyethyl)phenyl]-thiophen-2-ylmethanol
CID 55133973
(4-fluoro-3-methoxyphenyl)-[4-(2-methylpropyl)phenyl]methanol
CID 81289069
(4-fluorophenyl)-[4-(2-methoxyethyl)phenyl]methanamine
CID 43198335

Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol?
The IUPAC name of (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol (CID 61099736) is (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol.
What is the SMILES notation for (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol?
The canonical SMILES for (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol is COCCc1ccc(C(O)c2ccc(F)c(F)c2)cc1.
What is the InChIKey of (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol?
The InChIKey is JYTOYDRNFWYWQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O2/c1-20-9-8-11-2-4-12(5-3-11)16(19)13-6-7-14(17)15(18)10-13/h2-7,10,16,19H,8-9H2,1H3.
What are the key properties of (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol?
(3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol has a molecular weight of 278.30 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-[4-(2-methoxyethyl)phenyl]methanol is sourced from PubChem (CID 61099736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).