1-(2-bromophenyl)-2-phenylpropan-2-ol

C15H15BrO — CID 60798344

IUPAC1-(2-bromophenyl)-2-phenylpropan-2-ol
SMILESCC(O)(Cc1ccccc1Br)c1ccccc1
InChIInChI=1S/C15H15BrO/c1-15(17,13-8-3-2-4-9-13)11-12-7-5-6-10-14(12)16/h2-10,17H,11H2,1H3
InChIKeyUQWFMVSRSOCGDW-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.90
Rot. Bonds3

About 1-(2-bromophenyl)-2-phenylpropan-2-ol

1-(2-bromophenyl)-2-phenylpropan-2-ol (PubChem CID 60798344) has the molecular formula C15H15BrO and a molecular weight of 291.19 g/mol. Its IUPAC name is 1-(2-bromophenyl)-2-phenylpropan-2-ol.

Molecular Properties

Compound Name1-(2-bromophenyl)-2-phenylpropan-2-ol
PubChem CID60798344
Molecular FormulaC15H15BrO
Molecular Weight291.19 g/mol
Exact Mass290.03
IUPAC Name1-(2-bromophenyl)-2-phenylpropan-2-ol
SMILESCC(O)(Cc1ccccc1Br)c1ccccc1
InChIInChI=1S/C15H15BrO/c1-15(17,13-8-3-2-4-9-13)11-12-7-5-6-10-14(12)16/h2-10,17H,11H2,1H3
InChIKeyUQWFMVSRSOCGDW-UHFFFAOYSA-N
XLogP3.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-bromophenyl)-2-phenylpropan-2-ol?
The IUPAC name of 1-(2-bromophenyl)-2-phenylpropan-2-ol (CID 60798344) is 1-(2-bromophenyl)-2-phenylpropan-2-ol.
What is the SMILES notation for 1-(2-bromophenyl)-2-phenylpropan-2-ol?
The canonical SMILES for 1-(2-bromophenyl)-2-phenylpropan-2-ol is CC(O)(Cc1ccccc1Br)c1ccccc1.
What is the InChIKey of 1-(2-bromophenyl)-2-phenylpropan-2-ol?
The InChIKey is UQWFMVSRSOCGDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrO/c1-15(17,13-8-3-2-4-9-13)11-12-7-5-6-10-14(12)16/h2-10,17H,11H2,1H3.
What are the key properties of 1-(2-bromophenyl)-2-phenylpropan-2-ol?
1-(2-bromophenyl)-2-phenylpropan-2-ol has a molecular weight of 291.19 g/mol, XLogP of 3.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bromophenyl)-2-phenylpropan-2-ol is sourced from PubChem (CID 60798344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).