2-(2-bromophenyl)-2,2-difluoroethanol

C8H7BrF2O — CID 91926417

IUPAC2-(2-bromophenyl)-2,2-difluoroethanol
SMILESOCC(F)(F)c1ccccc1Br
InChIInChI=1S/C8H7BrF2O/c9-7-4-2-1-3-6(7)8(10,11)5-12/h1-4,12H,5H2
InChIKeyFIYINHRBZIWYNZ-UHFFFAOYSA-N
MW237.04 g/mol
LogP2.53
Rot. Bonds2

About 2-(2-bromophenyl)-2,2-difluoroethanol

2-(2-bromophenyl)-2,2-difluoroethanol (PubChem CID 91926417) has the molecular formula C8H7BrF2O and a molecular weight of 237.04 g/mol. Its IUPAC name is 2-(2-bromophenyl)-2,2-difluoroethanol.

Molecular Properties

Compound Name2-(2-bromophenyl)-2,2-difluoroethanol
PubChem CID91926417
Molecular FormulaC8H7BrF2O
Molecular Weight237.04 g/mol
Exact Mass235.96
IUPAC Name2-(2-bromophenyl)-2,2-difluoroethanol
SMILESOCC(F)(F)c1ccccc1Br
InChIInChI=1S/C8H7BrF2O/c9-7-4-2-1-3-6(7)8(10,11)5-12/h1-4,12H,5H2
InChIKeyFIYINHRBZIWYNZ-UHFFFAOYSA-N
XLogP2.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.04
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-bromo-2-(1,1-difluoropropyl)benzene
CID 116841343
2,2-difluoro-2-naphthalen-1-ylethanol
CID 116841204
1-bromo-2-(trifluoromethyl)benzene;phenol
CID 174917942
2-(2-bromophenyl)-2-[(4-fluorophenyl)methyl]propane-1,3-diol
CID 79448193
1-bromo-2-(1,1-difluoro-3-isocyanatopropyl)benzene
CID 84810772
2-(2-bromophenyl)-2-[3-(2,2,2-trifluoroethoxy)propyl]propane-1,3-diol
CID 79445713
2-(2,3-dichlorophenyl)-2,2-difluoroethanol
CID 130135852
2-(5-bromo-2-fluorophenyl)-2,2-difluoroethanol
CID 116841188
4-(2-bromophenyl)-1,1,1-trifluoro-4-methylpentan-2-one
CID 58026165
2-(1-benzothiophen-3-yl)-2,2-difluoroethanol
CID 67815156
1-bromo-2-[1-bromo-2-(bromomethyl)-3-(2,2,2-trifluoroethoxy)propan-2-yl]benzene
CID 106706660
2,2-difluoro-2-(3-fluoro-2-methoxyphenyl)ethanol
CID 105426357

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromophenyl)-2,2-difluoroethanol?
The IUPAC name of 2-(2-bromophenyl)-2,2-difluoroethanol (CID 91926417) is 2-(2-bromophenyl)-2,2-difluoroethanol.
What is the SMILES notation for 2-(2-bromophenyl)-2,2-difluoroethanol?
The canonical SMILES for 2-(2-bromophenyl)-2,2-difluoroethanol is OCC(F)(F)c1ccccc1Br.
What is the InChIKey of 2-(2-bromophenyl)-2,2-difluoroethanol?
The InChIKey is FIYINHRBZIWYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7BrF2O/c9-7-4-2-1-3-6(7)8(10,11)5-12/h1-4,12H,5H2.
What are the key properties of 2-(2-bromophenyl)-2,2-difluoroethanol?
2-(2-bromophenyl)-2,2-difluoroethanol has a molecular weight of 237.04 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromophenyl)-2,2-difluoroethanol is sourced from PubChem (CID 91926417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).