(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol

C14H10ClF3O — CID 82883112

IUPAC(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
SMILESCc1ccc(Cl)cc1C(O)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10ClF3O/c1-7-2-3-8(15)4-10(7)14(19)13-11(17)5-9(16)6-12(13)18/h2-6,14,19H,1H3
InChIKeyCYIJOTQRZNYMHG-UHFFFAOYSA-N
MW286.68 g/mol
LogP4.15
Rot. Bonds2

About (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol

(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol (PubChem CID 82883112) has the molecular formula C14H10ClF3O and a molecular weight of 286.68 g/mol. Its IUPAC name is (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol.

Molecular Properties

Compound Name(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
PubChem CID82883112
Molecular FormulaC14H10ClF3O
Molecular Weight286.68 g/mol
Exact Mass286.04
IUPAC Name(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
SMILESCc1ccc(Cl)cc1C(O)c1c(F)cc(F)cc1F
InChIInChI=1S/C14H10ClF3O/c1-7-2-3-8(15)4-10(7)14(19)13-11(17)5-9(16)6-12(13)18/h2-6,14,19H,1H3
InChIKeyCYIJOTQRZNYMHG-UHFFFAOYSA-N
XLogP4.15
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.68
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-fluoro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 63049832
(5-chloro-2-methylphenyl)-(2,4,6-trimethylphenyl)methanol
CID 82883722
(2,5-dichlorophenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879574
(2-fluoro-5-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 62509973
(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
CID 115800933
(5-chloro-2-methoxyphenyl)-(4-fluoro-2,6-dimethylphenyl)methanol
CID 106879586
(4-chlorophenyl)-(5-fluoro-2-methylphenyl)methanol
CID 55133948
(2,5-dichlorophenyl)-(2-fluoro-4,6-dimethylphenyl)methanol
CID 106884176
(2-chlorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089370
(2-chloro-4-fluorophenyl)-(2,4,6-trifluorophenyl)methanol
CID 61089185
(2,4-dichlorophenyl)-(2,6-difluoro-3-methylphenyl)methanol
CID 82816626
(2,5-dibromo-4-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 81473551

Frequently Asked Questions

What is the IUPAC name of (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol?
The IUPAC name of (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol (CID 82883112) is (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol.
What is the SMILES notation for (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol?
The canonical SMILES for (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol is Cc1ccc(Cl)cc1C(O)c1c(F)cc(F)cc1F.
What is the InChIKey of (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol?
The InChIKey is CYIJOTQRZNYMHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClF3O/c1-7-2-3-8(15)4-10(7)14(19)13-11(17)5-9(16)6-12(13)18/h2-6,14,19H,1H3.
What are the key properties of (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol?
(5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol has a molecular weight of 286.68 g/mol, XLogP of 4.15, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol is sourced from PubChem (CID 82883112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).