(2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol

C14H10BrClF2O — CID 107991288

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

About (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol

(2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol (PubChem CID 107991288) has the molecular formula C14H10BrClF2O and a molecular weight of 347.59 g/mol. Its IUPAC name is (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol.

Molecular Properties

Compound Name(2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol
PubChem CID107991288
Molecular FormulaC14H10BrClF2O
Molecular Weight347.59 g/mol
Exact Mass345.96
IUPAC Name(2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol
SMILESCc1cc(C(O)c2ccc(Cl)cc2Br)c(F)cc1F
InChIInChI=1S/C14H10BrClF2O/c1-7-4-10(13(18)6-12(7)17)14(19)9-3-2-8(16)5-11(9)15/h2-6,14,19H,1H3
InChIKeyLRKSUSHPDUSODH-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

(2-bromo-4-chlorophenyl)-(2,5-dibromo-4-methylphenyl)methanol
CID 107991315
(2-bromo-4-fluorophenyl)-(2-chloro-4-fluoro-5-methylphenyl)methanol
CID 81045240
(2-bromo-4-chlorophenyl)-(2-chloro-4,5-difluorophenyl)methanol
CID 107991378
(3-bromo-2-fluorophenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 106648345
(2-chloro-4-fluoro-5-methylphenyl)-(2-fluoro-5-methylphenyl)methanol
CID 81045090
(3-bromothiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanol
CID 79730854
(2-bromo-3-methylphenyl)-(4-chloro-2-fluorophenyl)methanol
CID 107985803
(2-bromo-4-chlorophenyl)-(2,5-dibromophenyl)methanol
CID 114024842
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
CID 107955698
(5-chlorothiophen-2-yl)-(2,4-difluoro-5-methylphenyl)methanol
CID 79731095
2-bromo-4-chloro-1-[chloro-(4-fluoro-3-methylphenyl)methyl]benzene
CID 107992000

Frequently Asked Questions

What is the IUPAC name of (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol?
The IUPAC name of (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol (CID 107991288) is (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol.
What is the SMILES notation for (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol?
The canonical SMILES for (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol is Cc1cc(C(O)c2ccc(Cl)cc2Br)c(F)cc1F.
What is the InChIKey of (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol?
The InChIKey is LRKSUSHPDUSODH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClF2O/c1-7-4-10(13(18)6-12(7)17)14(19)9-3-2-8(16)5-11(9)15/h2-6,14,19H,1H3.
What are the key properties of (2-bromo-4-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol?
(2-bromo-4-chlorophenyl)-(2,4-difluoro-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-chlorophenyl)-(2,4-difluoro-5-methylphenyl)methanol is sourced from PubChem (CID 107991288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).