2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol

C18H21ClO — CID 65145239

IUPAC2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol
SMILESCC(C)c1ccc(CC(C)(O)c2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClO/c1-13(2)15-10-8-14(9-11-15)12-18(3,20)16-6-4-5-7-17(16)19/h4-11,13,20H,12H2,1-3H3
InChIKeyMDYUQPWRTSFGTQ-UHFFFAOYSA-N
MW288.82 g/mol
LogP4.91
Rot. Bonds4

About 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol

2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol (PubChem CID 65145239) has the molecular formula C18H21ClO and a molecular weight of 288.82 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol
PubChem CID65145239
Molecular FormulaC18H21ClO
Molecular Weight288.82 g/mol
Exact Mass288.13
IUPAC Name2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol
SMILESCC(C)c1ccc(CC(C)(O)c2ccccc2Cl)cc1
InChIInChI=1S/C18H21ClO/c1-13(2)15-10-8-14(9-11-15)12-18(3,20)16-6-4-5-7-17(16)19/h4-11,13,20H,12H2,1-3H3
InChIKeyMDYUQPWRTSFGTQ-UHFFFAOYSA-N
XLogP4.91
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.82
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chlorophenyl)-1-phenylpropan-2-ol
CID 43810130
2-(2-chlorophenyl)-1-(3,4-dichlorophenyl)propan-2-ol
CID 65145288
2-(2-chlorophenyl)-4-methylpentan-2-ol
CID 43810129
2-(2-chlorophenyl)-1-(2-methylphenyl)propan-2-ol
CID 54919421
2-(2-chlorophenyl)-1-[3-(trifluoromethyl)phenyl]propan-2-ol
CID 65145336
1-(2-methyl-2-phenylpropyl)-4-propan-2-ylbenzene
CID 57304715
1-(2,2-dimethylpropyl)-4-propan-2-ylbenzene;methane
CID 166076943
2-(2-chlorophenyl)propan-2-ol
CID 12759846
1-(tert-butylamino)-2-(2-chlorophenyl)propan-2-ol
CID 62773407
4-amino-2-(2-chlorophenyl)butan-2-ol;hydrochloride
CID 140625468
1-(2-chloro-4-fluorophenyl)-2-(2-chlorophenyl)propan-2-ol
CID 65145046
2-(2-chlorophenyl)-1-(4-chlorophenyl)propan-2-amine
CID 60797835

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol?
The IUPAC name of 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol (CID 65145239) is 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol.
What is the SMILES notation for 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol?
The canonical SMILES for 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol is CC(C)c1ccc(CC(C)(O)c2ccccc2Cl)cc1.
What is the InChIKey of 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol?
The InChIKey is MDYUQPWRTSFGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClO/c1-13(2)15-10-8-14(9-11-15)12-18(3,20)16-6-4-5-7-17(16)19/h4-11,13,20H,12H2,1-3H3.
What are the key properties of 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol?
2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol has a molecular weight of 288.82 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-(4-propan-2-ylphenyl)propan-2-ol is sourced from PubChem (CID 65145239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).