1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol

C15H13BrF2O — CID 65145030

IUPAC1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(Br)ccc1F)c1ccc(F)cc1
InChIInChI=1S/C15H13BrF2O/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8,19H,9H2,1H3
InChIKeyINAOIOOSBAXUAJ-UHFFFAOYSA-N
MW327.17 g/mol
LogP4.18
Rot. Bonds3

About 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol

1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol (PubChem CID 65145030) has the molecular formula C15H13BrF2O and a molecular weight of 327.17 g/mol. Its IUPAC name is 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
PubChem CID65145030
Molecular FormulaC15H13BrF2O
Molecular Weight327.17 g/mol
Exact Mass326.01
IUPAC Name1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1cc(Br)ccc1F)c1ccc(F)cc1
InChIInChI=1S/C15H13BrF2O/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8,19H,9H2,1H3
InChIKeyINAOIOOSBAXUAJ-UHFFFAOYSA-N
XLogP4.18
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.17
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-chloro-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 103047472
2-(4-bromo-2-chlorophenyl)-1-(5-bromo-2-fluorophenyl)propan-2-ol
CID 82779362
2-(3-bromophenyl)-1-(5-chloro-2-fluorophenyl)propan-2-ol
CID 103047480
1-(2,5-dichlorophenyl)-2-(4-fluorophenyl)propan-2-ol
CID 65316898
4-bromo-2-[3-bromo-2-(bromomethyl)-2-methylpropyl]-1-fluorobenzene
CID 79453032
1-(5-bromo-2-fluorophenyl)-2-methylpropan-2-amine
CID 62622009
1-(4-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-amine
CID 55096347
1-(5-bromo-2-fluorophenyl)-3-(ethylamino)-2-methylpropan-2-ol
CID 66036998
1-(5-bromo-2-fluorophenyl)-2-phenylpropan-2-amine
CID 55096060
2-(3,4-difluorophenyl)-1-(2-fluorophenyl)propan-2-ol
CID 114832741
1-(5-bromo-2-fluorophenyl)-2-(3-bromophenyl)propan-2-amine
CID 63408364
1-(2-bromo-5-fluorophenyl)-2-(3,4-dimethylphenyl)propan-2-ol
CID 65146449

Frequently Asked Questions

What is the IUPAC name of 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol (CID 65145030) is 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol is CC(O)(Cc1cc(Br)ccc1F)c1ccc(F)cc1.
What is the InChIKey of 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol?
The InChIKey is INAOIOOSBAXUAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13BrF2O/c1-15(19,11-2-5-13(17)6-3-11)9-10-8-12(16)4-7-14(10)18/h2-8,19H,9H2,1H3.
What are the key properties of 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol?
1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol has a molecular weight of 327.17 g/mol, XLogP of 4.18, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-bromo-2-fluorophenyl)-2-(4-fluorophenyl)propan-2-ol is sourced from PubChem (CID 65145030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).