chlorobenzene;naphthalene

C16H13Cl — CID 70362178

IUPACchlorobenzene;naphthalene
SMILESClc1ccccc1.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.C6H5Cl/c1-2-6-10-8-4-3-7-9(10)5-1;7-6-4-2-1-3-5-6/h1-8H;1-5H
InChIKeyBWYUNUSESXAHKB-UHFFFAOYSA-N
MW240.73 g/mol
LogP5.18
Rot. Bonds

About chlorobenzene;naphthalene

chlorobenzene;naphthalene (PubChem CID 70362178) has the molecular formula C16H13Cl and a molecular weight of 240.73 g/mol. Its IUPAC name is chlorobenzene;naphthalene.

Molecular Properties

Compound Namechlorobenzene;naphthalene
PubChem CID70362178
Molecular FormulaC16H13Cl
Molecular Weight240.73 g/mol
Exact Mass240.07
IUPAC Namechlorobenzene;naphthalene
SMILESClc1ccccc1.c1ccc2ccccc2c1
InChIInChI=1S/C10H8.C6H5Cl/c1-2-6-10-8-4-3-7-9(10)5-1;7-6-4-2-1-3-5-6/h1-8H;1-5H
InChIKeyBWYUNUSESXAHKB-UHFFFAOYSA-N
XLogP5.18
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500240.73
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of chlorobenzene;naphthalene?
The IUPAC name of chlorobenzene;naphthalene (CID 70362178) is chlorobenzene;naphthalene.
What is the SMILES notation for chlorobenzene;naphthalene?
The canonical SMILES for chlorobenzene;naphthalene is Clc1ccccc1.c1ccc2ccccc2c1.
What is the InChIKey of chlorobenzene;naphthalene?
The InChIKey is BWYUNUSESXAHKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8.C6H5Cl/c1-2-6-10-8-4-3-7-9(10)5-1;7-6-4-2-1-3-5-6/h1-8H;1-5H.
What are the key properties of chlorobenzene;naphthalene?
chlorobenzene;naphthalene has a molecular weight of 240.73 g/mol, XLogP of 5.18, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chlorobenzene;naphthalene is sourced from PubChem (CID 70362178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).