2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene

C28H22 — CID 58943209

IUPAC2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene
SMILESCc1ccc2cc(-c3cccc(-c4ccc5cc(C)ccc5c4)c3)ccc2c1
InChIInChI=1S/C28H22/c1-19-6-8-25-17-27(12-10-23(25)14-19)21-4-3-5-22(16-21)28-13-11-24-15-20(2)7-9-26(24)18-28/h3-18H,1-2H3
InChIKeyIRWRGQPVTXMIDF-UHFFFAOYSA-N
MW358.48 g/mol
LogP7.94
Rot. Bonds2

About 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene

2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene (PubChem CID 58943209) has the molecular formula C28H22 and a molecular weight of 358.48 g/mol. Its IUPAC name is 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene.

Molecular Properties

Compound Name2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene
PubChem CID58943209
Molecular FormulaC28H22
Molecular Weight358.48 g/mol
Exact Mass358.17
IUPAC Name2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene
SMILESCc1ccc2cc(-c3cccc(-c4ccc5cc(C)ccc5c4)c3)ccc2c1
InChIInChI=1S/C28H22/c1-19-6-8-25-17-27(12-10-23(25)14-19)21-4-3-5-22(16-21)28-13-11-24-15-20(2)7-9-26(24)18-28/h3-18H,1-2H3
InChIKeyIRWRGQPVTXMIDF-UHFFFAOYSA-N
XLogP7.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.48
LogP ≤ 57.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

methane;2-methyl-6-phenylnaphthalene
CID 144703390
2-methyl-6-(6-methylnaphthalen-2-yl)anthracene
CID 140780842
2-[3-(4-methylphenyl)-5-(4-phenylphenyl)phenyl]naphthalene
CID 156673302
1-methyl-3-[4-[3-(4-methylphenyl)phenyl]phenyl]benzene
CID 58892418
1-methyl-3,5-diphenylbenzene;1-methyl-2-phenylbenzene;1-methyl-3-phenylbenzene;1-methyl-4-phenylbenzene;2-methyl-6-phenylnaphthalene
CID 157278644
2-(4-methoxyphenyl)-6-methylnaphthalene
CID 15099897
2-(4-methylphenyl)-7-phenylnaphthalene
CID 155763940
2-methoxy-6-[6-[6-(6-methylnaphthalen-2-yl)naphthalen-2-yl]naphthalen-2-yl]naphthalene
CID 58556071
9-(3-methylphenyl)-10-[6-(3-phenylphenyl)naphthalen-2-yl]anthracene
CID 163825229
methane;1-methyl-3-(4-methylphenyl)benzene
CID 158328523
1-methyl-3,5-bis[3-(4-methylphenyl)phenyl]benzene
CID 59552733
2-[3-[10-[6-[10-(6-methylnaphthalen-2-yl)anthracen-9-yl]naphthalen-2-yl]anthracen-9-yl]phenyl]-5-phenylthiophene
CID 58876218

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene?
The IUPAC name of 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene (CID 58943209) is 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene.
What is the SMILES notation for 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene?
The canonical SMILES for 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene is Cc1ccc2cc(-c3cccc(-c4ccc5cc(C)ccc5c4)c3)ccc2c1.
What is the InChIKey of 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene?
The InChIKey is IRWRGQPVTXMIDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22/c1-19-6-8-25-17-27(12-10-23(25)14-19)21-4-3-5-22(16-21)28-13-11-24-15-20(2)7-9-26(24)18-28/h3-18H,1-2H3.
What are the key properties of 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene?
2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene has a molecular weight of 358.48 g/mol, XLogP of 7.94, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[3-(6-methylnaphthalen-2-yl)phenyl]naphthalene is sourced from PubChem (CID 58943209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).