1,2,8-tris(ethenyl)naphthalene

C16H14 — CID 23355506

IUPAC1,2,8-tris(ethenyl)naphthalene
SMILESC=Cc1ccc2cccc(C=C)c2c1C=C
InChIInChI=1S/C16H14/c1-4-12-10-11-14-9-7-8-13(5-2)16(14)15(12)6-3/h4-11H,1-3H2
InChIKeyPTIUTJIWVGMLDW-UHFFFAOYSA-N
MW206.29 g/mol
LogP4.77
Rot. Bonds3

About 1,2,8-tris(ethenyl)naphthalene

1,2,8-tris(ethenyl)naphthalene (PubChem CID 23355506) has the molecular formula C16H14 and a molecular weight of 206.29 g/mol. Its IUPAC name is 1,2,8-tris(ethenyl)naphthalene.

Molecular Properties

Compound Name1,2,8-tris(ethenyl)naphthalene
PubChem CID23355506
Molecular FormulaC16H14
Molecular Weight206.29 g/mol
Exact Mass206.11
IUPAC Name1,2,8-tris(ethenyl)naphthalene
SMILESC=Cc1ccc2cccc(C=C)c2c1C=C
InChIInChI=1S/C16H14/c1-4-12-10-11-14-9-7-8-13(5-2)16(14)15(12)6-3/h4-11H,1-3H2
InChIKeyPTIUTJIWVGMLDW-UHFFFAOYSA-N
XLogP4.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2,8-tris(ethenyl)naphthalene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2,8-tris(ethenyl)naphthalene?
The IUPAC name of 1,2,8-tris(ethenyl)naphthalene (CID 23355506) is 1,2,8-tris(ethenyl)naphthalene.
What is the SMILES notation for 1,2,8-tris(ethenyl)naphthalene?
The canonical SMILES for 1,2,8-tris(ethenyl)naphthalene is C=Cc1ccc2cccc(C=C)c2c1C=C.
What is the InChIKey of 1,2,8-tris(ethenyl)naphthalene?
The InChIKey is PTIUTJIWVGMLDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14/c1-4-12-10-11-14-9-7-8-13(5-2)16(14)15(12)6-3/h4-11H,1-3H2.
What are the key properties of 1,2,8-tris(ethenyl)naphthalene?
1,2,8-tris(ethenyl)naphthalene has a molecular weight of 206.29 g/mol, XLogP of 4.77, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,8-tris(ethenyl)naphthalene is sourced from PubChem (CID 23355506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).