bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene

C252H236O2 — CID 162255256

IUPACbis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene
SMILESCCCC/C(=C(/c1ccccc1)c1ccc(-c2cccc3ccccc23)c2ccccc12)c1ccc(/C(CCCC)=C(\c2ccccc2)c2ccc(-c3cccc4ccccc34)c3ccccc23)cc1.CCCCC(=C(c1ccccc1)c1ccccc1)c1cc(OC)c(-c2c(OC)cc(C(CCCC)=C(c3ccccc3)c3ccccc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12
InChIInChI=1S/C70H58.2C62H62.C58H54O2/c1-3-5-31-57(69(53-25-9-7-10-26-53)67-47-45-65(61-35-17-19-37-63(61)67)59-39-21-29-49-23-13-15-33-55(49)59)51-41-43-52(44-42-51)58(32-6-4-2)70(54-27-11-8-12-28-54)68-48-46-66(62-36-18-20-38-64(62)68)60-40-22-30-50-24-14-16-34-56(50)60;2*1-7-9-11-12-22-60(62(49-35-27-45(5)28-36-49)50-37-29-46(6)30-38-50)58-42-40-56(52-19-14-16-21-54(52)58)55-39-41-57(53-20-15-13-18-51(53)55)59(17-10-8-2)61(47-31-23-43(3)24-32-47)48-33-25-44(4)26-34-48;1-5-7-33-49(55(41-25-13-9-14-26-41)42-27-15-10-16-28-42)51-39-53(59-3)57(47-37-23-21-35-45(47)51)58-48-38-24-22-36-46(48)52(40-54(58)60-4)50(34-8-6-2)56(43-29-17-11-18-30-43)44-31-19-12-20-32-44/h7-30,33-48H,3-6,31-32H2,1-2H3;2*13-16,18-21,23-42H,7-12,17,22H2,1-6H3;9-32,35-40H,5-8,33-34H2,1-4H3/b69-57+,70-58+;;;
InChIKeyZYMXUMXINSBRMP-LYYOSKLGSA-N
MW3296.66 g/mol
LogP71.85
Rot. Bonds59

About bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene

bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene (PubChem CID 162255256) has the molecular formula C252H236O2 and a molecular weight of 3296.66 g/mol. Its IUPAC name is bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene.

Molecular Properties

Compound Namebis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene
PubChem CID162255256
Molecular FormulaC252H236O2
Molecular Weight3296.66 g/mol
Exact Mass3293.84
IUPAC Namebis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene
SMILESCCCC/C(=C(/c1ccccc1)c1ccc(-c2cccc3ccccc23)c2ccccc12)c1ccc(/C(CCCC)=C(\c2ccccc2)c2ccc(-c3cccc4ccccc34)c3ccccc23)cc1.CCCCC(=C(c1ccccc1)c1ccccc1)c1cc(OC)c(-c2c(OC)cc(C(CCCC)=C(c3ccccc3)c3ccccc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12
InChIInChI=1S/C70H58.2C62H62.C58H54O2/c1-3-5-31-57(69(53-25-9-7-10-26-53)67-47-45-65(61-35-17-19-37-63(61)67)59-39-21-29-49-23-13-15-33-55(49)59)51-41-43-52(44-42-51)58(32-6-4-2)70(54-27-11-8-12-28-54)68-48-46-66(62-36-18-20-38-64(62)68)60-40-22-30-50-24-14-16-34-56(50)60;2*1-7-9-11-12-22-60(62(49-35-27-45(5)28-36-49)50-37-29-46(6)30-38-50)58-42-40-56(52-19-14-16-21-54(52)58)55-39-41-57(53-20-15-13-18-51(53)55)59(17-10-8-2)61(47-31-23-43(3)24-32-47)48-33-25-44(4)26-34-48;1-5-7-33-49(55(41-25-13-9-14-26-41)42-27-15-10-16-28-42)51-39-53(59-3)57(47-37-23-21-35-45(47)51)58-48-38-24-22-36-46(48)52(40-54(58)60-4)50(34-8-6-2)56(43-29-17-11-18-30-43)44-31-19-12-20-32-44/h7-30,33-48H,3-6,31-32H2,1-2H3;2*13-16,18-21,23-42H,7-12,17,22H2,1-6H3;9-32,35-40H,5-8,33-34H2,1-4H3/b69-57+,70-58+;;;
InChIKeyZYMXUMXINSBRMP-LYYOSKLGSA-N
XLogP71.85
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds59
Heavy Atoms254
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003296.66
LogP ≤ 571.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'stilbene', 'substructure': 'N/A'}

Analyze bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene with MolForge

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Related Compounds

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CID 318597
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CID 43547
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CID 614085
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CID 442695
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CID 102477417

Frequently Asked Questions

What is the IUPAC name of bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene?
The IUPAC name of bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene (CID 162255256) is bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene.
What is the SMILES notation for bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene?
The canonical SMILES for bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene is CCCC/C(=C(/c1ccccc1)c1ccc(-c2cccc3ccccc23)c2ccccc12)c1ccc(/C(CCCC)=C(\c2ccccc2)c2ccc(-c3cccc4ccccc34)c3ccccc23)cc1.CCCCC(=C(c1ccccc1)c1ccccc1)c1cc(OC)c(-c2c(OC)cc(C(CCCC)=C(c3ccccc3)c3ccccc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12.CCCCCCC(=C(c1ccc(C)cc1)c1ccc(C)cc1)c1ccc(-c2ccc(C(CCCC)=C(c3ccc(C)cc3)c3ccc(C)cc3)c3ccccc23)c2ccccc12.
What is the InChIKey of bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene?
The InChIKey is ZYMXUMXINSBRMP-LYYOSKLGSA-N. The full InChI is InChI=1S/C70H58.2C62H62.C58H54O2/c1-3-5-31-57(69(53-25-9-7-10-26-53)67-47-45-65(61-35-17-19-37-63(61)67)59-39-21-29-49-23-13-15-33-55(49)59)51-41-43-52(44-42-51)58(32-6-4-2)70(54-27-11-8-12-28-54)68-48-46-66(62-36-18-20-38-64(62)68)60-40-22-30-50-24-14-16-34-56(50)60;2*1-7-9-11-12-22-60(62(49-35-27-45(5)28-36-49)50-37-29-46(6)30-38-50)58-42-40-56(52-19-14-16-21-54(52)58)55-39-41-57(53-20-15-13-18-51(53)55)59(17-10-8-2)61(47-31-23-43(3)24-32-47)48-33-25-44(4)26-34-48;1-5-7-33-49(55(41-25-13-9-14-26-41)42-27-15-10-16-28-42)51-39-53(59-3)57(47-37-23-21-35-45(47)51)58-48-38-24-22-36-46(48)52(40-54(58)60-4)50(34-8-6-2)56(43-29-17-11-18-30-43)44-31-19-12-20-32-44/h7-30,33-48H,3-6,31-32H2,1-2H3;2*13-16,18-21,23-42H,7-12,17,22H2,1-6H3;9-32,35-40H,5-8,33-34H2,1-4H3/b69-57+,70-58+;;;.
What are the key properties of bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene?
bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene has a molecular weight of 3296.66 g/mol, XLogP of 71.85, 59 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-[1,1-bis(4-methylphenyl)hex-1-en-2-yl]-4-[4-[1,1-bis(4-methylphenyl)oct-1-en-2-yl]naphthalen-1-yl]naphthalene);4-(1,1-diphenylhex-1-en-2-yl)-1-[4-(1,1-diphenylhex-1-en-2-yl)-2-methoxynaphthalen-1-yl]-2-methoxynaphthalene;1-naphthalen-1-yl-4-[(E)-2-[4-[(E)-1-(4-naphthalen-1-ylnaphthalen-1-yl)-1-phenylhex-1-en-2-yl]phenyl]-1-phenylhex-1-enyl]naphthalene is sourced from PubChem (CID 162255256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).