2-(4-chlorophenyl)naphthalene

C16H11Cl — CID 11514224

IUPAC2-(4-chlorophenyl)naphthalene
SMILESClc1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H11Cl/c17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-11H
InChIKeyNWBYMXFSRXFVQK-UHFFFAOYSA-N
MW238.72 g/mol
LogP5.16
Rot. Bonds1

About 2-(4-chlorophenyl)naphthalene

2-(4-chlorophenyl)naphthalene (PubChem CID 11514224) has the molecular formula C16H11Cl and a molecular weight of 238.72 g/mol. Its IUPAC name is 2-(4-chlorophenyl)naphthalene.

Molecular Properties

Compound Name2-(4-chlorophenyl)naphthalene
PubChem CID11514224
Molecular FormulaC16H11Cl
Molecular Weight238.72 g/mol
Exact Mass238.05
IUPAC Name2-(4-chlorophenyl)naphthalene
SMILESClc1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H11Cl/c17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-11H
InChIKeyNWBYMXFSRXFVQK-UHFFFAOYSA-N
XLogP5.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500238.72
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)naphthalene?
The IUPAC name of 2-(4-chlorophenyl)naphthalene (CID 11514224) is 2-(4-chlorophenyl)naphthalene.
What is the SMILES notation for 2-(4-chlorophenyl)naphthalene?
The canonical SMILES for 2-(4-chlorophenyl)naphthalene is Clc1ccc(-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)naphthalene?
The InChIKey is NWBYMXFSRXFVQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11Cl/c17-16-9-7-13(8-10-16)15-6-5-12-3-1-2-4-14(12)11-15/h1-11H.
What are the key properties of 2-(4-chlorophenyl)naphthalene?
2-(4-chlorophenyl)naphthalene has a molecular weight of 238.72 g/mol, XLogP of 5.16, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)naphthalene is sourced from PubChem (CID 11514224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).