1-ethenylnaphthalene;1H-indene

C21H18 — CID 174801428

IUPAC1-ethenylnaphthalene;1H-indene
SMILESC1=Cc2ccccc2C1.C=Cc1cccc2ccccc12
InChIInChI=1S/C12H10.C9H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;1-2-5-9-7-3-6-8(9)4-1/h2-9H,1H2;1-6H,7H2
InChIKeyLZCDFLUCWVLULU-UHFFFAOYSA-N
MW270.38 g/mol
LogP5.74
Rot. Bonds1

About 1-ethenylnaphthalene;1H-indene

1-ethenylnaphthalene;1H-indene (PubChem CID 174801428) has the molecular formula C21H18 and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-ethenylnaphthalene;1H-indene.

Molecular Properties

Compound Name1-ethenylnaphthalene;1H-indene
PubChem CID174801428
Molecular FormulaC21H18
Molecular Weight270.38 g/mol
Exact Mass270.14
IUPAC Name1-ethenylnaphthalene;1H-indene
SMILESC1=Cc2ccccc2C1.C=Cc1cccc2ccccc12
InChIInChI=1S/C12H10.C9H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;1-2-5-9-7-3-6-8(9)4-1/h2-9H,1H2;1-6H,7H2
InChIKeyLZCDFLUCWVLULU-UHFFFAOYSA-N
XLogP5.74
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.38
LogP ≤ 55.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethenylnaphthalene;1H-indene?
The IUPAC name of 1-ethenylnaphthalene;1H-indene (CID 174801428) is 1-ethenylnaphthalene;1H-indene.
What is the SMILES notation for 1-ethenylnaphthalene;1H-indene?
The canonical SMILES for 1-ethenylnaphthalene;1H-indene is C1=Cc2ccccc2C1.C=Cc1cccc2ccccc12.
What is the InChIKey of 1-ethenylnaphthalene;1H-indene?
The InChIKey is LZCDFLUCWVLULU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10.C9H8/c1-2-10-7-5-8-11-6-3-4-9-12(10)11;1-2-5-9-7-3-6-8(9)4-1/h2-9H,1H2;1-6H,7H2.
What are the key properties of 1-ethenylnaphthalene;1H-indene?
1-ethenylnaphthalene;1H-indene has a molecular weight of 270.38 g/mol, XLogP of 5.74, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenylnaphthalene;1H-indene is sourced from PubChem (CID 174801428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).