5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene

C16H15Cl — CID 66253158

IUPAC5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene
SMILESCc1cccc(Cl)c1-c1ccc2c(c1)CCC2
InChIInChI=1S/C16H15Cl/c1-11-4-2-7-15(17)16(11)14-9-8-12-5-3-6-13(12)10-14/h2,4,7-10H,3,5-6H2,1H3
InChIKeyZDFDRAJFFQUNPG-UHFFFAOYSA-N
MW242.75 g/mol
LogP4.80
Rot. Bonds1

About 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene

5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene (PubChem CID 66253158) has the molecular formula C16H15Cl and a molecular weight of 242.75 g/mol. Its IUPAC name is 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene.

Molecular Properties

Compound Name5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene
PubChem CID66253158
Molecular FormulaC16H15Cl
Molecular Weight242.75 g/mol
Exact Mass242.09
IUPAC Name5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene
SMILESCc1cccc(Cl)c1-c1ccc2c(c1)CCC2
InChIInChI=1S/C16H15Cl/c1-11-4-2-7-15(17)16(11)14-9-8-12-5-3-6-13(12)10-14/h2,4,7-10H,3,5-6H2,1H3
InChIKeyZDFDRAJFFQUNPG-UHFFFAOYSA-N
XLogP4.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene?
The IUPAC name of 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene (CID 66253158) is 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene.
What is the SMILES notation for 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene?
The canonical SMILES for 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene is Cc1cccc(Cl)c1-c1ccc2c(c1)CCC2.
What is the InChIKey of 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene?
The InChIKey is ZDFDRAJFFQUNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl/c1-11-4-2-7-15(17)16(11)14-9-8-12-5-3-6-13(12)10-14/h2,4,7-10H,3,5-6H2,1H3.
What are the key properties of 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene?
5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene has a molecular weight of 242.75 g/mol, XLogP of 4.80, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-6-methylphenyl)-2,3-dihydro-1H-indene is sourced from PubChem (CID 66253158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).