(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol

C14H10BrClF2O — CID 107516210

IUPAC(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)c2cccc(Br)c2Cl)c(F)c1F
InChIInChI=1S/C14H10BrClF2O/c1-7-5-6-9(13(18)12(7)17)14(19)8-3-2-4-10(15)11(8)16/h2-6,14,19H,1H3
InChIKeyDELSOUDOGCHMMH-UHFFFAOYSA-N
MW347.59 g/mol
LogP4.77
Rot. Bonds2

About (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol

(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol (PubChem CID 107516210) has the molecular formula C14H10BrClF2O and a molecular weight of 347.59 g/mol. Its IUPAC name is (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol
PubChem CID107516210
Molecular FormulaC14H10BrClF2O
Molecular Weight347.59 g/mol
Exact Mass345.96
IUPAC Name(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol
SMILESCc1ccc(C(O)c2cccc(Br)c2Cl)c(F)c1F
InChIInChI=1S/C14H10BrClF2O/c1-7-5-6-9(13(18)12(7)17)14(19)8-3-2-4-10(15)11(8)16/h2-6,14,19H,1H3
InChIKeyDELSOUDOGCHMMH-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-chloro-3-fluorophenyl)-(2,3-difluoro-4-methylphenyl)methanol
CID 107516247
(3-bromo-2-fluorophenyl)-(2-fluoro-3-methylphenyl)methanol
CID 106648481
(3-bromo-2-chlorophenyl)-(2-chloro-5-fluorophenyl)methanol
CID 105397701
(S)-(3-bromo-2-fluorophenyl)-(2-chlorophenyl)methanol
CID 129410443
(3-bromo-2-fluorophenyl)-(2,6-dimethylphenyl)methanol
CID 106644550
(3-bromo-2-fluorophenyl)-(2-bromo-4-methylphenyl)methanol
CID 106644538
1-(3-bromo-2-chlorophenyl)-2-(5-fluoro-2-methylphenyl)ethanol
CID 105377688
(3-bromo-2-fluorophenyl)-(2,4-difluoro-5-methylphenyl)methanol
CID 106648345
(2-chloro-3-fluorophenyl)-(2,4,5-trimethylphenyl)methanol
CID 115807096
(3-bromo-2-fluorophenyl)-(4-fluoro-3,5-dimethylphenyl)methanol
CID 107955673
(3-bromo-2-chlorophenyl)-[2-(trifluoromethoxy)phenyl]methanol
CID 115792552
(5-chloro-2-methylphenyl)-(2,3-difluorophenyl)methanol
CID 115800933

Frequently Asked Questions

What is the IUPAC name of (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol?
The IUPAC name of (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol (CID 107516210) is (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol.
What is the SMILES notation for (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol?
The canonical SMILES for (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol is Cc1ccc(C(O)c2cccc(Br)c2Cl)c(F)c1F.
What is the InChIKey of (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol?
The InChIKey is DELSOUDOGCHMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrClF2O/c1-7-5-6-9(13(18)12(7)17)14(19)8-3-2-4-10(15)11(8)16/h2-6,14,19H,1H3.
What are the key properties of (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol?
(3-bromo-2-chlorophenyl)-(2,3-difluoro-4-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 (3-bromo-2-chlorophenyl)-(2,3-difluoro-4-methylphenyl)methanol is sourced from PubChem (CID 107516210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).