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

C13H8Cl2F2O — CID 105394068

IUPAC(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1F)c1cc(F)ccc1Cl
InChIInChI=1S/C13H8Cl2F2O/c14-7-1-3-9(12(17)5-7)13(18)10-6-8(16)2-4-11(10)15/h1-6,13,18H
InChIKeyULXHOPQMENWIQO-UHFFFAOYSA-N
MW289.11 g/mol
LogP4.35
Rot. Bonds2

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

(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol (PubChem CID 105394068) has the molecular formula C13H8Cl2F2O and a molecular weight of 289.11 g/mol. Its IUPAC name is (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol
PubChem CID105394068
Molecular FormulaC13H8Cl2F2O
Molecular Weight289.11 g/mol
Exact Mass287.99
IUPAC Name(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol
SMILESOC(c1ccc(Cl)cc1F)c1cc(F)ccc1Cl
InChIInChI=1S/C13H8Cl2F2O/c14-7-1-3-9(12(17)5-7)13(18)10-6-8(16)2-4-11(10)15/h1-6,13,18H
InChIKeyULXHOPQMENWIQO-UHFFFAOYSA-N
XLogP4.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.11
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,5-dichlorophenyl)-(4-fluoro-2-methylphenyl)methanol
CID 63894185
(4-bromo-2-chlorophenyl)-(2,4-difluorophenyl)methanol
CID 61087730
(2-chloro-5-fluorophenyl)methanediol
CID 71441110
1-(2-chloro-5-fluorophenyl)propane-1,2,3-triol
CID 170817435
(2,4-dichlorophenyl)-(4-fluorophenyl)methanol
CID 20506318
(4-chloro-2-fluorophenyl)-(3-chlorothiophen-2-yl)methanol
CID 80530486
(2,5-dichlorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879574
1-(4-chloro-2-fluorophenyl)propane-1,2,3-triol
CID 170817442
(2-chloro-5-fluorophenyl)-(2,4-difluorophenyl)methanamine
CID 105394907
4-chloro-2-fluoro-1-propan-2-ylbenzene;2,4-difluoro-1-propan-2-ylbenzene;ethane
CID 166121933
(2-bromo-5-chloro-4-pyridinyl)-(2,5-difluorophenyl)methanol
CID 23114659
(2,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 62510487

Frequently Asked Questions

What is the IUPAC name of (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol?
The IUPAC name of (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol (CID 105394068) is (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol.
What is the SMILES notation for (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol?
The canonical SMILES for (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol is OC(c1ccc(Cl)cc1F)c1cc(F)ccc1Cl.
What is the InChIKey of (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol?
The InChIKey is ULXHOPQMENWIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Cl2F2O/c14-7-1-3-9(12(17)5-7)13(18)10-6-8(16)2-4-11(10)15/h1-6,13,18H.
What are the key properties of (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol?
(2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol has a molecular weight of 289.11 g/mol, XLogP of 4.35, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-5-fluorophenyl)-(4-chloro-2-fluorophenyl)methanol is sourced from PubChem (CID 105394068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).