(3-chlorophenyl)-(3,5-difluorophenyl)methanol

C13H9ClF2O — CID 2757448

IUPAC(3-chlorophenyl)-(3,5-difluorophenyl)methanol
SMILESOC(c1cc(F)cc(F)c1)c1cccc(Cl)c1
InChIInChI=1S/C13H9ClF2O/c14-10-3-1-2-8(4-10)13(17)9-5-11(15)7-12(16)6-9/h1-7,13,17H
InChIKeyQMYZVECPIZFBQW-UHFFFAOYSA-N
MW254.66 g/mol
LogP3.70
Rot. Bonds2

About (3-chlorophenyl)-(3,5-difluorophenyl)methanol

(3-chlorophenyl)-(3,5-difluorophenyl)methanol (PubChem CID 2757448) has the molecular formula C13H9ClF2O and a molecular weight of 254.66 g/mol. Its IUPAC name is (3-chlorophenyl)-(3,5-difluorophenyl)methanol.

Molecular Properties

Compound Name(3-chlorophenyl)-(3,5-difluorophenyl)methanol
PubChem CID2757448
Molecular FormulaC13H9ClF2O
Molecular Weight254.66 g/mol
Exact Mass254.03
IUPAC Name(3-chlorophenyl)-(3,5-difluorophenyl)methanol
SMILESOC(c1cc(F)cc(F)c1)c1cccc(Cl)c1
InChIInChI=1S/C13H9ClF2O/c14-10-3-1-2-8(4-10)13(17)9-5-11(15)7-12(16)6-9/h1-7,13,17H
InChIKeyQMYZVECPIZFBQW-UHFFFAOYSA-N
XLogP3.70
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 ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(S)-(3-chloro-5-fluorophenyl)-(3-chlorophenyl)methanol
CID 7153369
(R)-(3-chloro-5-fluorophenyl)-(3-fluorophenyl)methanol
CID 7146499
(S)-(3-bromophenyl)-(3,5-difluorophenyl)methanol
CID 94601821
(3,5-difluorophenyl)-(3-iodophenyl)methanol
CID 115793177
3-amino-1-(3-chlorophenyl)-2-(3,5-difluorophenyl)propan-1-ol
CID 65189903
(3-chlorophenyl)-(3-phenylphenyl)methanol
CID 171366588
(3-chlorophenyl)-(4-iodophenyl)methanol
CID 114982492
(3-chloro-5-fluorophenyl)-(3-cyclopropyloxyphenyl)methanol
CID 114521051
(3-chlorophenyl)-fluoromethanol
CID 70239224
(3-chlorophenyl)methanediol
CID 20679602
(3-chlorophenyl)-(2,6-dichlorophenyl)methanol
CID 63894270
(R)-(3,4-dichlorophenyl)-(3-fluorophenyl)methanol
CID 7153378

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)-(3,5-difluorophenyl)methanol?
The IUPAC name of (3-chlorophenyl)-(3,5-difluorophenyl)methanol (CID 2757448) is (3-chlorophenyl)-(3,5-difluorophenyl)methanol.
What is the SMILES notation for (3-chlorophenyl)-(3,5-difluorophenyl)methanol?
The canonical SMILES for (3-chlorophenyl)-(3,5-difluorophenyl)methanol is OC(c1cc(F)cc(F)c1)c1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)-(3,5-difluorophenyl)methanol?
The InChIKey is QMYZVECPIZFBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9ClF2O/c14-10-3-1-2-8(4-10)13(17)9-5-11(15)7-12(16)6-9/h1-7,13,17H.
What are the key properties of (3-chlorophenyl)-(3,5-difluorophenyl)methanol?
(3-chlorophenyl)-(3,5-difluorophenyl)methanol has a molecular weight of 254.66 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)-(3,5-difluorophenyl)methanol is sourced from PubChem (CID 2757448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).