2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene

C27H24 — CID 58428339

IUPAC2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene
SMILESC=C(C)c1ccc(CCc2ccc3cc(-c4ccccc4)ccc3c2)cc1
InChIInChI=1S/C27H24/c1-20(2)23-13-10-21(11-14-23)8-9-22-12-15-27-19-26(17-16-25(27)18-22)24-6-4-3-5-7-24/h3-7,10-19H,1,8-9H2,2H3
InChIKeyLBCLRSVLXFLMPH-UHFFFAOYSA-N
MW348.49 g/mol
LogP7.33
Rot. Bonds5

About 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene

2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene (PubChem CID 58428339) has the molecular formula C27H24 and a molecular weight of 348.49 g/mol. Its IUPAC name is 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene.

Molecular Properties

Compound Name2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene
PubChem CID58428339
Molecular FormulaC27H24
Molecular Weight348.49 g/mol
Exact Mass348.19
IUPAC Name2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene
SMILESC=C(C)c1ccc(CCc2ccc3cc(-c4ccccc4)ccc3c2)cc1
InChIInChI=1S/C27H24/c1-20(2)23-13-10-21(11-14-23)8-9-22-12-15-27-19-26(17-16-25(27)18-22)24-6-4-3-5-7-24/h3-7,10-19H,1,8-9H2,2H3
InChIKeyLBCLRSVLXFLMPH-UHFFFAOYSA-N
XLogP7.33
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500348.49
LogP ≤ 57.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene?
The IUPAC name of 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene (CID 58428339) is 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene.
What is the SMILES notation for 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene?
The canonical SMILES for 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene is C=C(C)c1ccc(CCc2ccc3cc(-c4ccccc4)ccc3c2)cc1.
What is the InChIKey of 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene?
The InChIKey is LBCLRSVLXFLMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24/c1-20(2)23-13-10-21(11-14-23)8-9-22-12-15-27-19-26(17-16-25(27)18-22)24-6-4-3-5-7-24/h3-7,10-19H,1,8-9H2,2H3.
What are the key properties of 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene?
2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene has a molecular weight of 348.49 g/mol, XLogP of 7.33, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-[2-(4-prop-1-en-2-ylphenyl)ethyl]naphthalene is sourced from PubChem (CID 58428339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).