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

C14H10BrClF2O — CID 81045240

IUPAC(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
SMILESCc1cc(C(O)c2ccc(F)cc2Br)c(Cl)cc1F
InChIInChI=1S/C14H10BrClF2O/c1-7-4-10(12(16)6-13(7)18)14(19)9-3-2-8(17)5-11(9)15/h2-6,14,19H,1H3
InChIKeyUOCXOJNKTSLSOI-UHFFFAOYSA-N
MW347.59 g/mol
LogP4.77
Rot. Bonds2

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

(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol (PubChem CID 81045240) has the molecular formula C14H10BrClF2O and a molecular weight of 347.59 g/mol. Its IUPAC name is (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
PubChem CID81045240
Molecular FormulaC14H10BrClF2O
Molecular Weight347.59 g/mol
Exact Mass345.96
IUPAC Name(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
SMILESCc1cc(C(O)c2ccc(F)cc2Br)c(Cl)cc1F
InChIInChI=1S/C14H10BrClF2O/c1-7-4-10(12(16)6-13(7)18)14(19)9-3-2-8(17)5-11(9)15/h2-6,14,19H,1H3
InChIKeyUOCXOJNKTSLSOI-UHFFFAOYSA-N
XLogP4.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.59
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[(2-bromo-4-fluorophenyl)-chloromethyl]-2-chloro-4-fluoro-5-methylbenzene
CID 81051365
(2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 107991288
(2-bromo-5-fluorophenyl)-(2-chloro-4,5-dimethylphenyl)methanol
CID 115484503
(2-chloro-4-fluoro-5-methylphenyl)-(2-chloro-4-methylphenyl)methanol
CID 106862791
(2-bromo-4-fluorophenyl)-(2-chloro-4,5-dimethoxyphenyl)methanol
CID 61082589
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluorophenyl)methanol
CID 81045704
(2-bromo-4-chlorophenyl)-(2-chloro-4,5-difluorophenyl)methanol
CID 107991378
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 81045090
(2-chloro-4-fluoro-5-methylphenyl)-(2,5-dimethylphenyl)methanol
CID 81050730
(2-bromo-5-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanamine
CID 81045501
(2-chloro-4-fluoro-5-methylphenyl)-(2,3-dimethylphenyl)methanol
CID 81050964
(2-bromo-4-fluorophenyl)-(2,3-dichlorophenyl)methanol
CID 115793021

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol?
The IUPAC name of (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol (CID 81045240) is (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol.
What is the SMILES notation for (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol?
The canonical SMILES for (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol is Cc1cc(C(O)c2ccc(F)cc2Br)c(Cl)cc1F.
What is the InChIKey of (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol?
The InChIKey is UOCXOJNKTSLSOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClF2O/c1-7-4-10(12(16)6-13(7)18)14(19)9-3-2-8(17)5-11(9)15/h2-6,14,19H,1H3.
What are the key properties of (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol?
(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol has a molecular weight of 347.59 g/mol, XLogP of 4.77, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol is sourced from PubChem (CID 81045240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).