ethane;1-(4-ethylphenyl)naphthalene

C20H22 — CID 143262541

IUPACethane;1-(4-ethylphenyl)naphthalene
SMILESCC.CCc1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C18H16.C2H6/c1-2-14-10-12-16(13-11-14)18-9-5-7-15-6-3-4-8-17(15)18;1-2/h3-13H,2H2,1H3;1-2H3
InChIKeyGOPWWHVYBYJPBT-UHFFFAOYSA-N
MW262.40 g/mol
LogP6.10
Rot. Bonds2

About ethane;1-(4-ethylphenyl)naphthalene

ethane;1-(4-ethylphenyl)naphthalene (PubChem CID 143262541) has the molecular formula C20H22 and a molecular weight of 262.40 g/mol. Its IUPAC name is ethane;1-(4-ethylphenyl)naphthalene.

Molecular Properties

Compound Nameethane;1-(4-ethylphenyl)naphthalene
PubChem CID143262541
Molecular FormulaC20H22
Molecular Weight262.40 g/mol
Exact Mass262.17
IUPAC Nameethane;1-(4-ethylphenyl)naphthalene
SMILESCC.CCc1ccc(-c2cccc3ccccc23)cc1
InChIInChI=1S/C18H16.C2H6/c1-2-14-10-12-16(13-11-14)18-9-5-7-15-6-3-4-8-17(15)18;1-2/h3-13H,2H2,1H3;1-2H3
InChIKeyGOPWWHVYBYJPBT-UHFFFAOYSA-N
XLogP6.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.40
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of ethane;1-(4-ethylphenyl)naphthalene?
The IUPAC name of ethane;1-(4-ethylphenyl)naphthalene (CID 143262541) is ethane;1-(4-ethylphenyl)naphthalene.
What is the SMILES notation for ethane;1-(4-ethylphenyl)naphthalene?
The canonical SMILES for ethane;1-(4-ethylphenyl)naphthalene is CC.CCc1ccc(-c2cccc3ccccc23)cc1.
What is the InChIKey of ethane;1-(4-ethylphenyl)naphthalene?
The InChIKey is GOPWWHVYBYJPBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16.C2H6/c1-2-14-10-12-16(13-11-14)18-9-5-7-15-6-3-4-8-17(15)18;1-2/h3-13H,2H2,1H3;1-2H3.
What are the key properties of ethane;1-(4-ethylphenyl)naphthalene?
ethane;1-(4-ethylphenyl)naphthalene has a molecular weight of 262.40 g/mol, XLogP of 6.10, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-(4-ethylphenyl)naphthalene is sourced from PubChem (CID 143262541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).