1-ethylnaphthalene;1-phenylnaphthalene

C28H24 — CID 173023243

IUPAC1-ethylnaphthalene;1-phenylnaphthalene
SMILESCCc1cccc2ccccc12.c1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C16H12.C12H12/c1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1-12H;3-9H,2H2,1H3
InChIKeyVTXUHFZQLWTWAJ-UHFFFAOYSA-N
MW360.50 g/mol
LogP7.91
Rot. Bonds2

About 1-ethylnaphthalene;1-phenylnaphthalene

1-ethylnaphthalene;1-phenylnaphthalene (PubChem CID 173023243) has the molecular formula C28H24 and a molecular weight of 360.50 g/mol. Its IUPAC name is 1-ethylnaphthalene;1-phenylnaphthalene.

Molecular Properties

Compound Name1-ethylnaphthalene;1-phenylnaphthalene
PubChem CID173023243
Molecular FormulaC28H24
Molecular Weight360.50 g/mol
Exact Mass360.19
IUPAC Name1-ethylnaphthalene;1-phenylnaphthalene
SMILESCCc1cccc2ccccc12.c1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C16H12.C12H12/c1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1-12H;3-9H,2H2,1H3
InChIKeyVTXUHFZQLWTWAJ-UHFFFAOYSA-N
XLogP7.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500360.50
LogP ≤ 57.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

4-ethyl-6-naphthalen-1-yl-1-phenylnaphthalene
CID 161426162
azane;1-ethylnaphthalene
CID 19048185
sodium;1-ethylnaphthalene;hydride
CID 174300793
1-ethylnaphthalene;pyrene
CID 174849884
1-ethyl-3-phenyl-2-phenylmethoxybenzene
CID 123935467
ethane;1-(4-ethylphenyl)naphthalene
CID 143262541
sodium;1-ethylnaphthalene;phenoxide
CID 159168482
1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene
CID 145347928
ethane;bis(1-ethyl-2-phenylbenzene);propane
CID 145452261
ethane;N-(4-naphthalen-1-ylphenyl)-N,4-diphenylaniline
CID 143813904
1-ethylnaphthalene;methylcyclopropane
CID 142069670
2-bromo-1-ethyl-3-phenylbenzene
CID 174683375

Frequently Asked Questions

What is the IUPAC name of 1-ethylnaphthalene;1-phenylnaphthalene?
The IUPAC name of 1-ethylnaphthalene;1-phenylnaphthalene (CID 173023243) is 1-ethylnaphthalene;1-phenylnaphthalene.
What is the SMILES notation for 1-ethylnaphthalene;1-phenylnaphthalene?
The canonical SMILES for 1-ethylnaphthalene;1-phenylnaphthalene is CCc1cccc2ccccc12.c1ccc(-c2cccc3ccccc23)cc1.
What is the InChIKey of 1-ethylnaphthalene;1-phenylnaphthalene?
The InChIKey is VTXUHFZQLWTWAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12.C12H12/c1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-10-7-5-8-11-6-3-4-9-12(10)11/h1-12H;3-9H,2H2,1H3.
What are the key properties of 1-ethylnaphthalene;1-phenylnaphthalene?
1-ethylnaphthalene;1-phenylnaphthalene has a molecular weight of 360.50 g/mol, XLogP of 7.91, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylnaphthalene;1-phenylnaphthalene is sourced from PubChem (CID 173023243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).