1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene

C24H24 — CID 12865558

IUPAC1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(c1ccccc1)C1CCC(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H24/c1-18(19-10-4-2-5-11-19)21-16-17-22(20-12-6-3-7-13-20)24-15-9-8-14-23(21)24/h2-15,18,21-22H,16-17H2,1H3
InChIKeyGJJWHYDGEZUFOW-UHFFFAOYSA-N
MW312.46 g/mol
LogP6.50
Rot. Bonds3

About 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene

1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene (PubChem CID 12865558) has the molecular formula C24H24 and a molecular weight of 312.46 g/mol. Its IUPAC name is 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene.

Molecular Properties

Compound Name1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene
PubChem CID12865558
Molecular FormulaC24H24
Molecular Weight312.46 g/mol
Exact Mass312.19
IUPAC Name1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene
SMILESCC(c1ccccc1)C1CCC(c2ccccc2)c2ccccc21
InChIInChI=1S/C24H24/c1-18(19-10-4-2-5-11-19)21-16-17-22(20-12-6-3-7-13-20)24-15-9-8-14-23(21)24/h2-15,18,21-22H,16-17H2,1H3
InChIKeyGJJWHYDGEZUFOW-UHFFFAOYSA-N
XLogP6.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.46
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene?
The IUPAC name of 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene (CID 12865558) is 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene.
What is the SMILES notation for 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene?
The canonical SMILES for 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene is CC(c1ccccc1)C1CCC(c2ccccc2)c2ccccc21.
What is the InChIKey of 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene?
The InChIKey is GJJWHYDGEZUFOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24/c1-18(19-10-4-2-5-11-19)21-16-17-22(20-12-6-3-7-13-20)24-15-9-8-14-23(21)24/h2-15,18,21-22H,16-17H2,1H3.
What are the key properties of 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene?
1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene has a molecular weight of 312.46 g/mol, XLogP of 6.50, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-4-(1-phenylethyl)-1,2,3,4-tetrahydronaphthalene is sourced from PubChem (CID 12865558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).