(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol

C14H10BrF3O — CID 115794091

IUPAC(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol
SMILESCc1cc(F)ccc1C(O)c1c(F)cc(Br)cc1F
InChIInChI=1S/C14H10BrF3O/c1-7-4-9(16)2-3-10(7)14(19)13-11(17)5-8(15)6-12(13)18/h2-6,14,19H,1H3
InChIKeyUZXFPADDYCHLLY-UHFFFAOYSA-N
MW331.13 g/mol
LogP4.26
Rot. Bonds2

About (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol

(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol (PubChem CID 115794091) has the molecular formula C14H10BrF3O and a molecular weight of 331.13 g/mol. Its IUPAC name is (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol.

Molecular Properties

Compound Name(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol
PubChem CID115794091
Molecular FormulaC14H10BrF3O
Molecular Weight331.13 g/mol
Exact Mass329.99
IUPAC Name(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol
SMILESCc1cc(F)ccc1C(O)c1c(F)cc(Br)cc1F
InChIInChI=1S/C14H10BrF3O/c1-7-4-9(16)2-3-10(7)14(19)13-11(17)5-8(15)6-12(13)18/h2-6,14,19H,1H3
InChIKeyUZXFPADDYCHLLY-UHFFFAOYSA-N
XLogP4.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.13
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

bis(4-fluoro-2-methylphenyl)methanol
CID 14371387
(4-bromo-2-methylphenyl)-(2,4-difluorophenyl)methanol
CID 61087729
(2-bromo-5-fluorophenyl)-(4-fluoro-2-methylphenyl)methanol
CID 115794207
(5-fluoro-2-methylphenyl)-(2,4,6-trifluorophenyl)methanol
CID 63049832
(4-bromo-2-methoxyphenyl)-(4-fluoro-2-methylphenyl)methanol
CID 115794081
(2-bromofuran-3-yl)-(4-fluoro-2-methylphenyl)methanol
CID 106859200
(2,5-dibromothiophen-3-yl)-(4-fluoro-2-methylphenyl)methanol
CID 113400075
(4-fluoro-2-methylphenyl)-(4-methylphenyl)methanol
CID 62791480
(2,5-dichlorophenyl)-(4-fluoro-2-methylphenyl)methanol
CID 63894185
2-(3-bromo-5-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanol
CID 79702447
(3-bromofuran-2-yl)-(4-fluoro-2-methylphenyl)methanol
CID 63941244
(1S)-1-(4-fluoro-2-methylphenyl)propan-1-ol
CID 79002158

Frequently Asked Questions

What is the IUPAC name of (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol?
The IUPAC name of (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol (CID 115794091) is (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol.
What is the SMILES notation for (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol?
The canonical SMILES for (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol is Cc1cc(F)ccc1C(O)c1c(F)cc(Br)cc1F.
What is the InChIKey of (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol?
The InChIKey is UZXFPADDYCHLLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF3O/c1-7-4-9(16)2-3-10(7)14(19)13-11(17)5-8(15)6-12(13)18/h2-6,14,19H,1H3.
What are the key properties of (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol?
(4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol has a molecular weight of 331.13 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-2,6-difluorophenyl)-(4-fluoro-2-methylphenyl)methanol is sourced from PubChem (CID 115794091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).