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

C13H9ClF2O — CID 172653766

IUPAC[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol
SMILESOCc1ccc(F)cc1-c1cc(F)ccc1Cl
InChIInChI=1S/C13H9ClF2O/c14-13-4-3-10(16)6-12(13)11-5-9(15)2-1-8(11)7-17/h1-6,17H,7H2
InChIKeyHXOVZNOQHQLGLG-UHFFFAOYSA-N
MW254.66 g/mol
LogP3.78
Rot. Bonds2

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

[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol (PubChem CID 172653766) has the molecular formula C13H9ClF2O and a molecular weight of 254.66 g/mol. Its IUPAC name is [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol.

Molecular Properties

Compound Name[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol
PubChem CID172653766
Molecular FormulaC13H9ClF2O
Molecular Weight254.66 g/mol
Exact Mass254.03
IUPAC Name[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol
SMILESOCc1ccc(F)cc1-c1cc(F)ccc1Cl
InChIInChI=1S/C13H9ClF2O/c14-13-4-3-10(16)6-12(13)11-5-9(15)2-1-8(11)7-17/h1-6,17H,7H2
InChIKeyHXOVZNOQHQLGLG-UHFFFAOYSA-N
XLogP3.78
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.66
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[5-(2-chloro-5-fluorophenyl)-2-methylphenyl]methanol
CID 172654205
1-[2-(bromomethyl)-5-fluorophenyl]-2,4,5-trichlorobenzene
CID 134619464
2-(2-chloro-5-fluorophenyl)-5-fluorobenzoic acid
CID 105395623
[2-(2,4-dichlorophenyl)-5-fluorophenyl]methanol
CID 118807413
[2-(2-chloro-5-fluorophenyl)phenyl]methanamine
CID 105395671
[2-(2-chloro-5-fluorophenyl)-4-ethoxyphenyl]methanamine
CID 172653787
[3-(2-chloro-5-fluorophenyl)-4-(trifluoromethoxy)phenyl]methanol
CID 172653860
N-[[4-chloro-2-(2-chloro-5-fluorophenyl)phenyl]methyl]propan-1-amine
CID 105395768
[4-chloro-2-(3-fluorophenyl)phenyl]methanol
CID 168865521
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-fluoro-3-(hydroxymethyl)phenyl]methanol
CID 99823533
4-(2-chloro-5-fluorophenyl)aniline
CID 105395647
[2-(2-chloro-5-fluorophenyl)-4-propan-2-yloxyphenyl]methanamine;hydrochloride
CID 172653793

Frequently Asked Questions

What is the IUPAC name of [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol?
The IUPAC name of [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol (CID 172653766) is [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol.
What is the SMILES notation for [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol?
The canonical SMILES for [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol is OCc1ccc(F)cc1-c1cc(F)ccc1Cl.
What is the InChIKey of [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol?
The InChIKey is HXOVZNOQHQLGLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2O/c14-13-4-3-10(16)6-12(13)11-5-9(15)2-1-8(11)7-17/h1-6,17H,7H2.
What are the key properties of [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol?
[2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol has a molecular weight of 254.66 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chloro-5-fluorophenyl)-4-fluorophenyl]methanol is sourced from PubChem (CID 172653766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).