1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene

C28H22 — CID 145347928

IUPAC1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene
SMILESCCc1cc(-c2ccccc2)cc2ccc(-c3cccc4ccccc34)cc12
InChIInChI=1S/C28H22/c1-2-20-17-25(21-9-4-3-5-10-21)18-23-15-16-24(19-28(20)23)27-14-8-12-22-11-6-7-13-26(22)27/h3-19H,2H2,1H3
InChIKeyFDGQRZUCKPDFRW-UHFFFAOYSA-N
MW358.48 g/mol
LogP7.89
Rot. Bonds3

About 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene

1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene (PubChem CID 145347928) has the molecular formula C28H22 and a molecular weight of 358.48 g/mol. Its IUPAC name is 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene.

Molecular Properties

Compound Name1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene
PubChem CID145347928
Molecular FormulaC28H22
Molecular Weight358.48 g/mol
Exact Mass358.17
IUPAC Name1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene
SMILESCCc1cc(-c2ccccc2)cc2ccc(-c3cccc4ccccc34)cc12
InChIInChI=1S/C28H22/c1-2-20-17-25(21-9-4-3-5-10-21)18-23-15-16-24(19-28(20)23)27-14-8-12-22-11-6-7-13-26(22)27/h3-19H,2H2,1H3
InChIKeyFDGQRZUCKPDFRW-UHFFFAOYSA-N
XLogP7.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.48
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-naphthalen-1-yl-7-(4-phenylphenyl)phenanthrene
CID 59638748
4-ethyl-6-naphthalen-1-yl-1-phenylnaphthalene
CID 161426162
2-(3,5-diethylphenyl)-6-(4-naphthalen-1-ylphenyl)naphthalene
CID 174141308
1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
CID 168844837
1-ethylnaphthalene;1-phenylnaphthalene
CID 173023243
1,3-diphenylbenzene;ethane;1-phenylnaphthalene;2-phenylnaphthalene
CID 157179117
4-N-[4-(7-naphthalen-1-ylnaphthalen-1-yl)phenyl]-1-N,4-N-diphenyl-1-N-(4-phenylphenyl)benzene-1,4-diamine
CID 176588104
9-(3-phenylnaphthalen-1-yl)-10-(7-phenylnaphthalen-1-yl)anthracene
CID 156677059
1-(3-naphthalen-2-ylphenyl)naphthalene
CID 153293143
4-(3-naphthalen-1-ylphenyl)-N-[4-(3-naphthalen-1-ylphenyl)phenyl]-N-[4-[7-(7-phenylnaphthalen-2-yl)naphthalen-2-yl]phenyl]aniline
CID 118901528
N,N-bis(4-naphthalen-1-ylphenyl)-4-(7-phenylphenanthren-2-yl)aniline
CID 138742492
9-(3,5-diphenylphenyl)-10-(7-naphthalen-2-ylnaphthalen-2-yl)anthracene;9-(7-naphthalen-1-ylnaphthalen-2-yl)-10-(3-phenylphenyl)anthracene
CID 159267964

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene?
The IUPAC name of 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene (CID 145347928) is 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene.
What is the SMILES notation for 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene?
The canonical SMILES for 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene is CCc1cc(-c2ccccc2)cc2ccc(-c3cccc4ccccc34)cc12.
What is the InChIKey of 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene?
The InChIKey is FDGQRZUCKPDFRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22/c1-2-20-17-25(21-9-4-3-5-10-21)18-23-15-16-24(19-28(20)23)27-14-8-12-22-11-6-7-13-26(22)27/h3-19H,2H2,1H3.
What are the key properties of 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene?
1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene has a molecular weight of 358.48 g/mol, XLogP of 7.89, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-7-naphthalen-1-yl-3-phenylnaphthalene is sourced from PubChem (CID 145347928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).