2-phenyl-1-(3-propan-2-ylphenyl)ethanol

C17H20O — CID 59798288

IUPAC2-phenyl-1-(3-propan-2-ylphenyl)ethanol
SMILESCC(C)c1cccc(C(O)Cc2ccccc2)c1
InChIInChI=1S/C17H20O/c1-13(2)15-9-6-10-16(12-15)17(18)11-14-7-4-3-5-8-14/h3-10,12-13,17-18H,11H2,1-2H3
InChIKeyYENGQOFFSZDQBE-UHFFFAOYSA-N
MW240.35 g/mol
LogP4.09
Rot. Bonds4

About 2-phenyl-1-(3-propan-2-ylphenyl)ethanol

2-phenyl-1-(3-propan-2-ylphenyl)ethanol (PubChem CID 59798288) has the molecular formula C17H20O and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-phenyl-1-(3-propan-2-ylphenyl)ethanol.

Molecular Properties

Compound Name2-phenyl-1-(3-propan-2-ylphenyl)ethanol
PubChem CID59798288
Molecular FormulaC17H20O
Molecular Weight240.35 g/mol
Exact Mass240.15
IUPAC Name2-phenyl-1-(3-propan-2-ylphenyl)ethanol
SMILESCC(C)c1cccc(C(O)Cc2ccccc2)c1
InChIInChI=1S/C17H20O/c1-13(2)15-9-6-10-16(12-15)17(18)11-14-7-4-3-5-8-14/h3-10,12-13,17-18H,11H2,1-2H3
InChIKeyYENGQOFFSZDQBE-UHFFFAOYSA-N
XLogP4.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[3-(difluoromethyl)phenyl]-2-phenylethanol
CID 115527640
(1R)-1,2-diphenylethanol
CID 1379022
1-(3-propan-2-ylphenyl)ethane-1,2-diol
CID 155397805
1-(3-propan-2-ylphenyl)propan-2-ol
CID 21243708
1-naphthalen-2-yl-2-phenylethanol
CID 2793947
1-(3-methylsulfonylphenyl)-2-phenylethanol
CID 114976498
1-(3-cyclopropylphenyl)-2-(4-propan-2-ylphenyl)ethanol
CID 79973012
2-methyl-1-(3-propan-2-ylphenyl)propan-1-ol
CID 22486943
(2R,3S)-3,4-diphenylbutan-2-ol
CID 166439857
1-(3-ethylphenyl)-2-naphthalen-2-ylethanol
CID 105117200
1-(4-bromo-3-methylphenyl)-2-phenylethanol
CID 81447483
1-[3-(difluoromethyl)phenyl]-2-(4-iodophenyl)ethanol
CID 115527785

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-1-(3-propan-2-ylphenyl)ethanol?
The IUPAC name of 2-phenyl-1-(3-propan-2-ylphenyl)ethanol (CID 59798288) is 2-phenyl-1-(3-propan-2-ylphenyl)ethanol.
What is the SMILES notation for 2-phenyl-1-(3-propan-2-ylphenyl)ethanol?
The canonical SMILES for 2-phenyl-1-(3-propan-2-ylphenyl)ethanol is CC(C)c1cccc(C(O)Cc2ccccc2)c1.
What is the InChIKey of 2-phenyl-1-(3-propan-2-ylphenyl)ethanol?
The InChIKey is YENGQOFFSZDQBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20O/c1-13(2)15-9-6-10-16(12-15)17(18)11-14-7-4-3-5-8-14/h3-10,12-13,17-18H,11H2,1-2H3.
What are the key properties of 2-phenyl-1-(3-propan-2-ylphenyl)ethanol?
2-phenyl-1-(3-propan-2-ylphenyl)ethanol has a molecular weight of 240.35 g/mol, XLogP of 4.09, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-1-(3-propan-2-ylphenyl)ethanol is sourced from PubChem (CID 59798288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).