[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol

C14H11ClF2O2 — CID 114850200

IUPAC[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol
SMILESOCc1cc(F)cc(OCc2ccc(Cl)cc2F)c1
InChIInChI=1S/C14H11ClF2O2/c15-11-2-1-10(14(17)5-11)8-19-13-4-9(7-18)3-12(16)6-13/h1-6,18H,7-8H2
InChIKeyFILCMQTYZDPALE-UHFFFAOYSA-N
MW284.69 g/mol
LogP3.69
Rot. Bonds4

About [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol

[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol (PubChem CID 114850200) has the molecular formula C14H11ClF2O2 and a molecular weight of 284.69 g/mol. Its IUPAC name is [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol.

Molecular Properties

Compound Name[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol
PubChem CID114850200
Molecular FormulaC14H11ClF2O2
Molecular Weight284.69 g/mol
Exact Mass284.04
IUPAC Name[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol
SMILESOCc1cc(F)cc(OCc2ccc(Cl)cc2F)c1
InChIInChI=1S/C14H11ClF2O2/c15-11-2-1-10(14(17)5-11)8-19-13-4-9(7-18)3-12(16)6-13/h1-6,18H,7-8H2
InChIKeyFILCMQTYZDPALE-UHFFFAOYSA-N
XLogP3.69
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.69
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-fluoro-5-[(2-fluoro-4-methoxyphenyl)methoxy]phenyl]methanol
CID 102877142
[3-chloro-4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 114850107
[3-bromo-4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 114850115
4-chloro-1-[(4-ethylphenoxy)methyl]-2-fluorobenzene
CID 114860237
1-[(4-bromophenoxy)methyl]-4-chloro-2-fluorobenzene
CID 97046774
[3-(3-chlorophenoxy)-5-fluorophenyl]methanol
CID 106530131
2-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanethioamide
CID 114849176
2-[(4-chloro-2-fluorophenyl)methoxy]-5-(chloromethyl)-1,3-difluorobenzene
CID 114850377
1-(chloromethyl)-3-[(2-chloro-4-methylphenyl)methoxy]-5-fluorobenzene
CID 106864606
(1R)-1-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]ethanol
CID 104980144
2-[4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]-N'-hydroxyethanimidamide
CID 114849592
[3-[(4-chloro-2-fluorophenyl)methoxy]-4-nitrophenyl]methanol
CID 114850111

Frequently Asked Questions

What is the IUPAC name of [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol?
The IUPAC name of [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol (CID 114850200) is [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol.
What is the SMILES notation for [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol?
The canonical SMILES for [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol is OCc1cc(F)cc(OCc2ccc(Cl)cc2F)c1.
What is the InChIKey of [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol?
The InChIKey is FILCMQTYZDPALE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClF2O2/c15-11-2-1-10(14(17)5-11)8-19-13-4-9(7-18)3-12(16)6-13/h1-6,18H,7-8H2.
What are the key properties of [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol?
[3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol has a molecular weight of 284.69 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(4-chloro-2-fluorophenyl)methoxy]-5-fluorophenyl]methanol is sourced from PubChem (CID 114850200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).