5-chloro-2,3-dihydronaphthalene

C10H9Cl — CID 154214824

IUPAC5-chloro-2,3-dihydronaphthalene
SMILESClc1cccc2c1=CCCC=2
InChIInChI=1S/C10H9Cl/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3-7H,1-2H2
InChIKeyJECZABAUKQFIJY-UHFFFAOYSA-N
MW164.63 g/mol
LogP1.69
Rot. Bonds

About 5-chloro-2,3-dihydronaphthalene

5-chloro-2,3-dihydronaphthalene (PubChem CID 154214824) has the molecular formula C10H9Cl and a molecular weight of 164.63 g/mol. Its IUPAC name is 5-chloro-2,3-dihydronaphthalene.

Molecular Properties

Compound Name5-chloro-2,3-dihydronaphthalene
PubChem CID154214824
Molecular FormulaC10H9Cl
Molecular Weight164.63 g/mol
Exact Mass164.04
IUPAC Name5-chloro-2,3-dihydronaphthalene
SMILESClc1cccc2c1=CCCC=2
InChIInChI=1S/C10H9Cl/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3-7H,1-2H2
InChIKeyJECZABAUKQFIJY-UHFFFAOYSA-N
XLogP1.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.63
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-2,3-dihydronaphthalene?
The IUPAC name of 5-chloro-2,3-dihydronaphthalene (CID 154214824) is 5-chloro-2,3-dihydronaphthalene.
What is the SMILES notation for 5-chloro-2,3-dihydronaphthalene?
The canonical SMILES for 5-chloro-2,3-dihydronaphthalene is Clc1cccc2c1=CCCC=2.
What is the InChIKey of 5-chloro-2,3-dihydronaphthalene?
The InChIKey is JECZABAUKQFIJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl/c11-10-7-3-5-8-4-1-2-6-9(8)10/h3-7H,1-2H2.
What are the key properties of 5-chloro-2,3-dihydronaphthalene?
5-chloro-2,3-dihydronaphthalene has a molecular weight of 164.63 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2,3-dihydronaphthalene is sourced from PubChem (CID 154214824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).