(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol

C15H13F3O — CID 107516130

IUPAC(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2ccc(C)c(F)c2F)c1
InChIInChI=1S/C15H13F3O/c1-8-3-6-12(16)11(7-8)15(19)10-5-4-9(2)13(17)14(10)18/h3-7,15,19H,1-2H3
InChIKeyAPBOOXOMKADDLM-UHFFFAOYSA-N
MW266.26 g/mol
LogP3.80
Rot. Bonds2

About (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol

(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol (PubChem CID 107516130) has the molecular formula C15H13F3O and a molecular weight of 266.26 g/mol. Its IUPAC name is (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
PubChem CID107516130
Molecular FormulaC15H13F3O
Molecular Weight266.26 g/mol
Exact Mass266.09
IUPAC Name(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
SMILESCc1ccc(F)c(C(O)c2ccc(C)c(F)c2F)c1
InChIInChI=1S/C15H13F3O/c1-8-3-6-12(16)11(7-8)15(19)10-5-4-9(2)13(17)14(10)18/h3-7,15,19H,1-2H3
InChIKeyAPBOOXOMKADDLM-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,3-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 63894755
(2,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 62510487
(2-fluoro-5-methylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 62790310
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 81045090
(5-fluoro-2-methylphenyl)-(2,3,4-trifluorophenyl)methanol
CID 62964628
(2-fluoro-5-methylphenyl)-(2-methoxy-5-methylphenyl)methanol
CID 62509628
(2-fluoro-5-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 62509973
(2-fluoro-5-methylphenyl)-(2-iodophenyl)methanol
CID 115794497
2,3-difluoro-1,4-dimethylbenzene;2-fluoro-1,4-dimethylbenzene
CID 90931442
(5-bromo-2-fluorophenyl)-(2-bromo-5-methylphenyl)methanol
CID 115820779
(2,3-difluoro-4-methylphenyl)-(4-methyl-2-pyridinyl)methanol
CID 107512882
(2-chloro-4-fluoro-5-methylphenyl)-(2,5-dimethylphenyl)methanol
CID 81050730

Frequently Asked Questions

What is the IUPAC name of (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The IUPAC name of (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol (CID 107516130) is (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The canonical SMILES for (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol is Cc1ccc(F)c(C(O)c2ccc(C)c(F)c2F)c1.
What is the InChIKey of (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
The InChIKey is APBOOXOMKADDLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3O/c1-8-3-6-12(16)11(7-8)15(19)10-5-4-9(2)13(17)14(10)18/h3-7,15,19H,1-2H3.
What are the key properties of (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol?
(2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol has a molecular weight of 266.26 g/mol, XLogP of 3.80, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-difluoro-4-methylphenyl)-(2-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 107516130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).