(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol

C15H13ClF2O — CID 81045090

IUPAC(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2cc(C)c(F)cc2Cl)c1
InChIInChI=1S/C15H13ClF2O/c1-8-3-4-13(17)11(5-8)15(19)10-6-9(2)14(18)7-12(10)16/h3-7,15,19H,1-2H3
InChIKeyVNERGIYFVHZNFU-UHFFFAOYSA-N
MW282.72 g/mol
LogP4.32
Rot. Bonds2

About (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol

(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol (PubChem CID 81045090) has the molecular formula C15H13ClF2O and a molecular weight of 282.72 g/mol. Its IUPAC name is (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
PubChem CID81045090
Molecular FormulaC15H13ClF2O
Molecular Weight282.72 g/mol
Exact Mass282.06
IUPAC Name(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2cc(C)c(F)cc2Cl)c1
InChIInChI=1S/C15H13ClF2O/c1-8-3-4-13(17)11(5-8)15(19)10-6-9(2)14(18)7-12(10)16/h3-7,15,19H,1-2H3
InChIKeyVNERGIYFVHZNFU-UHFFFAOYSA-N
XLogP4.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.72
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2-chloro-4-fluoro-5-methylphenyl)-(2,5-dimethylphenyl)methanol
CID 81050730
(2-chloro-4-fluoro-5-methylphenyl)-(2-chloro-4-methylphenyl)methanol
CID 106862791
(2-chloro-4-fluoro-5-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 81045703
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluorophenyl)methanol
CID 81045704
(2-chloro-4-fluoro-5-methylphenyl)-(2,3-dimethylphenyl)methanol
CID 81050964
(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 107516130
(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
CID 81045240
(2-chloro-4-fluoro-5-methylphenyl)-(2-chloro-4-methylphenyl)methanamine
CID 106861126
1-chloro-2-[chloro-(2,4-dimethylphenyl)methyl]-5-fluoro-4-methylbenzene
CID 81050811
(2-chloro-4,5-dimethylphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 115484419
1-[(2-bromo-5-methylphenyl)-chloromethyl]-2-chloro-4-fluoro-5-methylbenzene
CID 81116914
(2,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 62510487

Frequently Asked Questions

What is the IUPAC name of (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The IUPAC name of (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol (CID 81045090) is (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The canonical SMILES for (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol is Cc1ccc(F)c(C(O)c2cc(C)c(F)cc2Cl)c1.
What is the InChIKey of (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The InChIKey is VNERGIYFVHZNFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2O/c1-8-3-4-13(17)11(5-8)15(19)10-6-9(2)14(18)7-12(10)16/h3-7,15,19H,1-2H3.
What are the key properties of (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol has a molecular weight of 282.72 g/mol, XLogP of 4.32, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 81045090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).