(7aR)-2,7a-dihydro-1H-indene

C9H10 — CID 91327704

IUPAC(7aR)-2,7a-dihydro-1H-indene
SMILESC1=CC2=CCC[C@@H]2C=C1
InChIInChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-6,9H,3,7H2/t9-/m0/s1
InChIKeyONGQFBPMCULLTR-VIFPVBQESA-N
MW118.18 g/mol
LogP2.45
Rot. Bonds

About (7aR)-2,7a-dihydro-1H-indene

(7aR)-2,7a-dihydro-1H-indene (PubChem CID 91327704) has the molecular formula C9H10 and a molecular weight of 118.18 g/mol. Its IUPAC name is (7aR)-2,7a-dihydro-1H-indene.

Molecular Properties

Compound Name(7aR)-2,7a-dihydro-1H-indene
PubChem CID91327704
Molecular FormulaC9H10
Molecular Weight118.18 g/mol
Exact Mass118.08
IUPAC Name(7aR)-2,7a-dihydro-1H-indene
SMILESC1=CC2=CCC[C@@H]2C=C1
InChIInChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-6,9H,3,7H2/t9-/m0/s1
InChIKeyONGQFBPMCULLTR-VIFPVBQESA-N
XLogP2.45
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 ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (7aR)-2,7a-dihydro-1H-indene?
The IUPAC name of (7aR)-2,7a-dihydro-1H-indene (CID 91327704) is (7aR)-2,7a-dihydro-1H-indene.
What is the SMILES notation for (7aR)-2,7a-dihydro-1H-indene?
The canonical SMILES for (7aR)-2,7a-dihydro-1H-indene is C1=CC2=CCC[C@@H]2C=C1.
What is the InChIKey of (7aR)-2,7a-dihydro-1H-indene?
The InChIKey is ONGQFBPMCULLTR-VIFPVBQESA-N. The full InChI is InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-6,9H,3,7H2/t9-/m0/s1.
What are the key properties of (7aR)-2,7a-dihydro-1H-indene?
(7aR)-2,7a-dihydro-1H-indene has a molecular weight of 118.18 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (7aR)-2,7a-dihydro-1H-indene is sourced from PubChem (CID 91327704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).