2-chloro-4-phenyl-6-propan-2-ylphenol

C15H15ClO — CID 146604618

IUPAC2-chloro-4-phenyl-6-propan-2-ylphenol
SMILESCC(C)c1cc(-c2ccccc2)cc(Cl)c1O
InChIInChI=1S/C15H15ClO/c1-10(2)13-8-12(9-14(16)15(13)17)11-6-4-3-5-7-11/h3-10,17H,1-2H3
InChIKeyUVXLJDSZLIPJCS-UHFFFAOYSA-N
MW246.74 g/mol
LogP4.84
Rot. Bonds2

About 2-chloro-4-phenyl-6-propan-2-ylphenol

2-chloro-4-phenyl-6-propan-2-ylphenol (PubChem CID 146604618) has the molecular formula C15H15ClO and a molecular weight of 246.74 g/mol. Its IUPAC name is 2-chloro-4-phenyl-6-propan-2-ylphenol.

Molecular Properties

Compound Name2-chloro-4-phenyl-6-propan-2-ylphenol
PubChem CID146604618
Molecular FormulaC15H15ClO
Molecular Weight246.74 g/mol
Exact Mass246.08
IUPAC Name2-chloro-4-phenyl-6-propan-2-ylphenol
SMILESCC(C)c1cc(-c2ccccc2)cc(Cl)c1O
InChIInChI=1S/C15H15ClO/c1-10(2)13-8-12(9-14(16)15(13)17)11-6-4-3-5-7-11/h3-10,17H,1-2H3
InChIKeyUVXLJDSZLIPJCS-UHFFFAOYSA-N
XLogP4.84
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.74
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-phenyl-6-propan-2-ylphenol?
The IUPAC name of 2-chloro-4-phenyl-6-propan-2-ylphenol (CID 146604618) is 2-chloro-4-phenyl-6-propan-2-ylphenol.
What is the SMILES notation for 2-chloro-4-phenyl-6-propan-2-ylphenol?
The canonical SMILES for 2-chloro-4-phenyl-6-propan-2-ylphenol is CC(C)c1cc(-c2ccccc2)cc(Cl)c1O.
What is the InChIKey of 2-chloro-4-phenyl-6-propan-2-ylphenol?
The InChIKey is UVXLJDSZLIPJCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClO/c1-10(2)13-8-12(9-14(16)15(13)17)11-6-4-3-5-7-11/h3-10,17H,1-2H3.
What are the key properties of 2-chloro-4-phenyl-6-propan-2-ylphenol?
2-chloro-4-phenyl-6-propan-2-ylphenol has a molecular weight of 246.74 g/mol, XLogP of 4.84, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-phenyl-6-propan-2-ylphenol is sourced from PubChem (CID 146604618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).