ethane;(3E)-3-propylidene-1,2-dihydroindene

C14H20 — CID 143438466

IUPACethane;(3E)-3-propylidene-1,2-dihydroindene
SMILESCC.CC/C=C1\CCc2ccccc21
InChIInChI=1S/C12H14.C2H6/c1-2-5-10-8-9-11-6-3-4-7-12(10)11;1-2/h3-7H,2,8-9H2,1H3;1-2H3/b10-5+;
InChIKeyHIBXEINPIPGEQI-OAZHBLANSA-N
MW188.31 g/mol
LogP4.45
Rot. Bonds1

About ethane;(3E)-3-propylidene-1,2-dihydroindene

ethane;(3E)-3-propylidene-1,2-dihydroindene (PubChem CID 143438466) has the molecular formula C14H20 and a molecular weight of 188.31 g/mol. Its IUPAC name is ethane;(3E)-3-propylidene-1,2-dihydroindene.

Molecular Properties

Compound Nameethane;(3E)-3-propylidene-1,2-dihydroindene
PubChem CID143438466
Molecular FormulaC14H20
Molecular Weight188.31 g/mol
Exact Mass188.16
IUPAC Nameethane;(3E)-3-propylidene-1,2-dihydroindene
SMILESCC.CC/C=C1\CCc2ccccc21
InChIInChI=1S/C12H14.C2H6/c1-2-5-10-8-9-11-6-3-4-7-12(10)11;1-2/h3-7H,2,8-9H2,1H3;1-2H3/b10-5+;
InChIKeyHIBXEINPIPGEQI-OAZHBLANSA-N
XLogP4.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.31
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;(3E)-3-propylidene-1,2-dihydroindene?
The IUPAC name of ethane;(3E)-3-propylidene-1,2-dihydroindene (CID 143438466) is ethane;(3E)-3-propylidene-1,2-dihydroindene.
What is the SMILES notation for ethane;(3E)-3-propylidene-1,2-dihydroindene?
The canonical SMILES for ethane;(3E)-3-propylidene-1,2-dihydroindene is CC.CC/C=C1\CCc2ccccc21.
What is the InChIKey of ethane;(3E)-3-propylidene-1,2-dihydroindene?
The InChIKey is HIBXEINPIPGEQI-OAZHBLANSA-N. The full InChI is InChI=1S/C12H14.C2H6/c1-2-5-10-8-9-11-6-3-4-7-12(10)11;1-2/h3-7H,2,8-9H2,1H3;1-2H3/b10-5+;.
What are the key properties of ethane;(3E)-3-propylidene-1,2-dihydroindene?
ethane;(3E)-3-propylidene-1,2-dihydroindene has a molecular weight of 188.31 g/mol, XLogP of 4.45, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;(3E)-3-propylidene-1,2-dihydroindene is sourced from PubChem (CID 143438466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).