2,4-dihydro-1H-indene

C9H10 — CID 54303970

IUPAC2,4-dihydro-1H-indene
SMILESC1=CCC2=CCCC2=C1
InChIInChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4,7H,3,5-6H2
InChIKeyKOERXBHXXBPBKA-UHFFFAOYSA-N
MW118.18 g/mol
LogP2.59
Rot. Bonds

About 2,4-dihydro-1H-indene

2,4-dihydro-1H-indene (PubChem CID 54303970) has the molecular formula C9H10 and a molecular weight of 118.18 g/mol. Its IUPAC name is 2,4-dihydro-1H-indene.

Molecular Properties

Compound Name2,4-dihydro-1H-indene
PubChem CID54303970
Molecular FormulaC9H10
Molecular Weight118.18 g/mol
Exact Mass118.08
IUPAC Name2,4-dihydro-1H-indene
SMILESC1=CCC2=CCCC2=C1
InChIInChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4,7H,3,5-6H2
InChIKeyKOERXBHXXBPBKA-UHFFFAOYSA-N
XLogP2.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,4-dihydro-1H-indene?
The IUPAC name of 2,4-dihydro-1H-indene (CID 54303970) is 2,4-dihydro-1H-indene.
What is the SMILES notation for 2,4-dihydro-1H-indene?
The canonical SMILES for 2,4-dihydro-1H-indene is C1=CCC2=CCCC2=C1.
What is the InChIKey of 2,4-dihydro-1H-indene?
The InChIKey is KOERXBHXXBPBKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4,7H,3,5-6H2.
What are the key properties of 2,4-dihydro-1H-indene?
2,4-dihydro-1H-indene has a molecular weight of 118.18 g/mol, XLogP of 2.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dihydro-1H-indene is sourced from PubChem (CID 54303970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).