1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene

C50H34 — CID 168844837

IUPAC1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc(-c4ccc(-c5cccc6ccccc56)cc4)c3)cc2)cc1
InChIInChI=1S/C50H34/c1-2-9-35(10-3-1)37-17-21-39(22-18-37)46-32-47(40-23-19-38(20-24-40)45-30-27-36-11-4-5-13-44(36)31-45)34-48(33-46)41-25-28-43(29-26-41)50-16-8-14-42-12-6-7-15-49(42)50/h1-34H
InChIKeyVOEUBSODUWTHSW-UHFFFAOYSA-N
MW634.82 g/mol
LogP13.99
Rot. Bonds6

About 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene

1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene (PubChem CID 168844837) has the molecular formula C50H34 and a molecular weight of 634.82 g/mol. Its IUPAC name is 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene.

Molecular Properties

Compound Name1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
PubChem CID168844837
Molecular FormulaC50H34
Molecular Weight634.82 g/mol
Exact Mass634.27
IUPAC Name1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene
SMILESc1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc(-c4ccc(-c5cccc6ccccc56)cc4)c3)cc2)cc1
InChIInChI=1S/C50H34/c1-2-9-35(10-3-1)37-17-21-39(22-18-37)46-32-47(40-23-19-38(20-24-40)45-30-27-36-11-4-5-13-44(36)31-45)34-48(33-46)41-25-28-43(29-26-41)50-16-8-14-42-12-6-7-15-49(42)50/h1-34H
InChIKeyVOEUBSODUWTHSW-UHFFFAOYSA-N
XLogP13.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms50
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500634.82
LogP ≤ 513.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,3-diphenylbenzene;ethane;1-phenylnaphthalene;2-phenylnaphthalene
CID 157179117
1-[3-naphthalen-2-yl-5-[4-[4-(3-naphthalen-1-yl-5-naphthalen-2-ylphenyl)phenyl]phenyl]phenyl]naphthalene
CID 18710973
1-(3-naphthalen-2-ylphenyl)naphthalene
CID 153293143
9-[7-(3,5-diphenylphenyl)naphthalen-2-yl]-10-(3-phenylphenyl)anthracene;9-[7-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]-10-(3-phenylphenyl)anthracene
CID 160659436
9-naphthalen-2-yl-10-[3-naphthalen-2-yl-5-(3-naphthalen-2-ylphenyl)phenyl]anthracene;9-naphthalen-2-yl-10-(3-naphthalen-1-yl-5-phenylphenyl)anthracene;9-naphthalen-2-yl-10-[3-[3-(3-naphthalen-2-ylphenyl)phenyl]-5-phenylphenyl]anthracene;9-naphthalen-2-yl-10-[3-phenyl-5-(6-phenylnaphthalen-2-yl)phenyl]anthracene
CID 158188509
9-(3-naphthalen-2-ylphenyl)-10-[6-(4-naphthalen-1-ylphenyl)naphthalen-2-yl]anthracene
CID 123921245
9,10-bis(3-naphthalen-1-ylphenyl)anthracene;9,10-bis(3-naphthalen-2-ylphenyl)anthracene;9,10-bis(4-naphthalen-1-ylphenyl)anthracene;9,10-bis(4-naphthalen-2-ylphenyl)anthracene;9-(3-naphthalen-1-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(3-naphthalen-2-ylphenyl)-10-(4-phenylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-(3-phenylphenyl)anthracene
CID 161131758
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
1-[4-[3-(4-naphthalen-1-ylphenyl)phenyl]phenyl]naphthalene
CID 10983707
9-(4-naphthalen-1-ylphenyl)-10-(4-naphthalen-2-ylphenyl)anthracene;9-(4-naphthalen-1-ylphenyl)-10-[3-(4-naphthalen-2-ylphenyl)phenyl]anthracene
CID 159854260
9-(4-naphthalen-1-ylphenyl)-10-[3-(6-phenylnaphthalen-2-yl)phenyl]anthracene
CID 58856435
9,10-bis(3,5-diphenylphenyl)anthracene;9,10-dinaphthalen-1-ylanthracene;9-(3,5-dinaphthalen-1-ylphenyl)-10-phenylanthracene;9-naphthalen-2-yl-10-(4-naphthalen-1-ylphenyl)anthracene;9-naphthalen-2-yl-10-phenylanthracene;9-(4-naphthalen-2-ylphenyl)-10-phenylanthracene
CID 160579417

Frequently Asked Questions

What is the IUPAC name of 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene?
The IUPAC name of 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene (CID 168844837) is 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene.
What is the SMILES notation for 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene?
The canonical SMILES for 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene is c1ccc(-c2ccc(-c3cc(-c4ccc(-c5ccc6ccccc6c5)cc4)cc(-c4ccc(-c5cccc6ccccc56)cc4)c3)cc2)cc1.
What is the InChIKey of 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene?
The InChIKey is VOEUBSODUWTHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C50H34/c1-2-9-35(10-3-1)37-17-21-39(22-18-37)46-32-47(40-23-19-38(20-24-40)45-30-27-36-11-4-5-13-44(36)31-45)34-48(33-46)41-25-28-43(29-26-41)50-16-8-14-42-12-6-7-15-49(42)50/h1-34H.
What are the key properties of 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene?
1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene has a molecular weight of 634.82 g/mol, XLogP of 13.99, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[3-(4-naphthalen-2-ylphenyl)-5-(4-phenylphenyl)phenyl]phenyl]naphthalene is sourced from PubChem (CID 168844837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).