(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol

C14H10BrF3O — CID 107955698

IUPAC(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
SMILESCc1cc(F)c(C(O)c2ccc(F)c(Br)c2)cc1F
InChIInChI=1S/C14H10BrF3O/c1-7-4-13(18)9(6-12(7)17)14(19)8-2-3-11(16)10(15)5-8/h2-6,14,19H,1H3
InChIKeyKZJQJDUVOQYOHQ-UHFFFAOYSA-N
MW331.13 g/mol
LogP4.26
Rot. Bonds2

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

(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol (PubChem CID 107955698) has the molecular formula C14H10BrF3O and a molecular weight of 331.13 g/mol. Its IUPAC name is (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol.

Molecular Properties

Compound Name(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
PubChem CID107955698
Molecular FormulaC14H10BrF3O
Molecular Weight331.13 g/mol
Exact Mass329.99
IUPAC Name(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol
SMILESCc1cc(F)c(C(O)c2ccc(F)c(Br)c2)cc1F
InChIInChI=1S/C14H10BrF3O/c1-7-4-13(18)9(6-12(7)17)14(19)8-2-3-11(16)10(15)5-8/h2-6,14,19H,1H3
InChIKeyKZJQJDUVOQYOHQ-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

Analyze (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-bromo-4-methylphenyl)-(2,5-difluoro-4-methylphenyl)methanol
CID 81475821
(4-bromo-2,5-dimethylphenyl)-(3-bromo-4-fluorophenyl)methanol
CID 107955646
(3-bromo-4-fluorophenyl)-(2-chloro-4,5-dimethylphenyl)methanol
CID 107955735
1-(3-bromo-4-fluorophenyl)-1-(2,5-difluoro-4-methylphenyl)-N-methylmethanamine
CID 107950732
(3-bromo-4-fluorophenyl)-(2-bromo-3-methylphenyl)methanol
CID 114023972
(5-bromo-2-fluorophenyl)-(4-bromo-3-methylphenyl)methanol
CID 81447497
(4-bromo-5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 105399490
(3-bromo-4-fluorophenyl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 102751415
(3-bromo-4-fluorophenyl)-(4,5-dimethoxy-2-methylphenyl)methanol
CID 107955586
(3-bromo-4-fluorophenyl)-(4-bromothiophen-3-yl)methanol
CID 79595160
(3-bromo-4-fluorophenyl)-(2,5-dimethylfuran-3-yl)methanol
CID 79747617
N-[(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methyl]ethanamine
CID 107950736

Frequently Asked Questions

What is the IUPAC name of (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol?
The IUPAC name of (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol (CID 107955698) is (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol.
What is the SMILES notation for (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol?
The canonical SMILES for (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol is Cc1cc(F)c(C(O)c2ccc(F)c(Br)c2)cc1F.
What is the InChIKey of (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol?
The InChIKey is KZJQJDUVOQYOHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10BrF3O/c1-7-4-13(18)9(6-12(7)17)14(19)8-2-3-11(16)10(15)5-8/h2-6,14,19H,1H3.
What are the key properties of (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol?
(3-bromo-4-fluorophenyl)-(2,5-difluoro-4-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 (3-bromo-4-fluorophenyl)-(2,5-difluoro-4-methylphenyl)methanol is sourced from PubChem (CID 107955698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).