2-(2-chlorophenyl)-1-naphthalen-2-ylethanol

C18H15ClO — CID 62715892

IUPAC2-(2-chlorophenyl)-1-naphthalen-2-ylethanol
SMILESOC(Cc1ccccc1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C18H15ClO/c19-17-8-4-3-7-15(17)12-18(20)16-10-9-13-5-1-2-6-14(13)11-16/h1-11,18,20H,12H2
InChIKeyYWCRDQIFSHGHBM-UHFFFAOYSA-N
MW282.77 g/mol
LogP4.77
Rot. Bonds3

About 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol

2-(2-chlorophenyl)-1-naphthalen-2-ylethanol (PubChem CID 62715892) has the molecular formula C18H15ClO and a molecular weight of 282.77 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol.

Molecular Properties

Compound Name2-(2-chlorophenyl)-1-naphthalen-2-ylethanol
PubChem CID62715892
Molecular FormulaC18H15ClO
Molecular Weight282.77 g/mol
Exact Mass282.08
IUPAC Name2-(2-chlorophenyl)-1-naphthalen-2-ylethanol
SMILESOC(Cc1ccccc1Cl)c1ccc2ccccc2c1
InChIInChI=1S/C18H15ClO/c19-17-8-4-3-7-15(17)12-18(20)16-10-9-13-5-1-2-6-14(13)11-16/h1-11,18,20H,12H2
InChIKeyYWCRDQIFSHGHBM-UHFFFAOYSA-N
XLogP4.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.77
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol?
The IUPAC name of 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol (CID 62715892) is 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol.
What is the SMILES notation for 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol?
The canonical SMILES for 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol is OC(Cc1ccccc1Cl)c1ccc2ccccc2c1.
What is the InChIKey of 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol?
The InChIKey is YWCRDQIFSHGHBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClO/c19-17-8-4-3-7-15(17)12-18(20)16-10-9-13-5-1-2-6-14(13)11-16/h1-11,18,20H,12H2.
What are the key properties of 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol?
2-(2-chlorophenyl)-1-naphthalen-2-ylethanol has a molecular weight of 282.77 g/mol, XLogP of 4.77, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-1-naphthalen-2-ylethanol is sourced from PubChem (CID 62715892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).