2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol

C34H28O2 — CID 175154022

IUPAC2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol
SMILESOCCOc1ccc2ccccc2c1-c1cccc2c1C=CCC2(c1ccccc1)c1ccccc1
InChIInChI=1S/C34H28O2/c35-23-24-36-32-21-20-25-11-7-8-16-28(25)33(32)30-17-9-19-31-29(30)18-10-22-34(31,26-12-3-1-4-13-26)27-14-5-2-6-15-27/h1-21,35H,22-24H2
InChIKeyJZAHLFQGMZDVBW-UHFFFAOYSA-N
MW468.60 g/mol
LogP7.63
Rot. Bonds6

About 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol

2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol (PubChem CID 175154022) has the molecular formula C34H28O2 and a molecular weight of 468.60 g/mol. Its IUPAC name is 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol.

Molecular Properties

Compound Name2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol
PubChem CID175154022
Molecular FormulaC34H28O2
Molecular Weight468.60 g/mol
Exact Mass468.21
IUPAC Name2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol
SMILESOCCOc1ccc2ccccc2c1-c1cccc2c1C=CCC2(c1ccccc1)c1ccccc1
InChIInChI=1S/C34H28O2/c35-23-24-36-32-21-20-25-11-7-8-16-28(25)33(32)30-17-9-19-31-29(30)18-10-22-34(31,26-12-3-1-4-13-26)27-14-5-2-6-15-27/h1-21,35H,22-24H2
InChIKeyJZAHLFQGMZDVBW-UHFFFAOYSA-N
XLogP7.63
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.60
LogP ≤ 57.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(3,3-diphenyl-2H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol
CID 175157433
2-[1-[2-[[4-[[1-[2-(2-hydroxyethoxy)naphthalen-1-yl]naphthalen-2-yl]oxymethyl]phenyl]methoxy]naphthalen-1-yl]naphthalen-2-yl]oxyethanol
CID 169258581
2-[1-[2-(2-methoxyethoxy)naphthalen-1-yl]naphthalen-2-yl]oxyethanol
CID 144623852
2-[2-[2-[1-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]naphthalen-1-yl]naphthalen-2-yl]oxyethoxy]ethoxy]ethanol
CID 12994977
2-[4-[9-[4-(2-hydroxyethoxy)-3,5-bis(4-naphthalen-1-ylphenyl)phenyl]fluoren-9-yl]-2,6-bis(4-naphthalen-1-ylphenyl)phenoxy]ethanol
CID 172515739
2-[1-[7-[[3-[[1-[2-(2-hydroxyethoxy)naphthalen-1-yl]naphthalen-2-yl]oxymethyl]phenyl]methoxy]naphthalen-1-yl]naphthalen-2-yl]oxyethanol
CID 176864187
2-[1-[2-(2-hydroxyethoxy)naphthalen-1-yl]naphthalen-2-yl]oxyethanol;bis(2-methylprop-2-enoic acid)
CID 86743802
2-[4-phenyl-1-(4,6,6-triphenyl-5H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol
CID 175370699
2-[4-[9-[4-(2-hydroxyethoxy)naphthalen-1-yl]-1,8-dinaphthalen-1-ylfluoren-9-yl]naphthalen-1-yl]oxyethanol
CID 142536432
2-[6-[9-[6-(2-hydroxyethoxy)naphthalen-2-yl]-4,5-dinaphthalen-1-ylfluoren-9-yl]naphthalen-2-yl]oxyethanol
CID 142536387
2-[1-(7,7-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyacetic acid
CID 175561008
2-[4-[9-[4-(2-hydroxyethoxy)-3-methylphenyl]-4,5-dinaphthalen-2-ylfluoren-9-yl]-2-methylphenoxy]ethanol
CID 142536393

Frequently Asked Questions

What is the IUPAC name of 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol?
The IUPAC name of 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol (CID 175154022) is 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol.
What is the SMILES notation for 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol?
The canonical SMILES for 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol is OCCOc1ccc2ccccc2c1-c1cccc2c1C=CCC2(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol?
The InChIKey is JZAHLFQGMZDVBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H28O2/c35-23-24-36-32-21-20-25-11-7-8-16-28(25)33(32)30-17-9-19-31-29(30)18-10-22-34(31,26-12-3-1-4-13-26)27-14-5-2-6-15-27/h1-21,35H,22-24H2.
What are the key properties of 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol?
2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol has a molecular weight of 468.60 g/mol, XLogP of 7.63, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(5,5-diphenyl-6H-naphthalen-1-yl)naphthalen-2-yl]oxyethanol is sourced from PubChem (CID 175154022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).