9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole

C150H98N2 — CID 159091690

IUPAC9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole
SMILESCc1c2ccccc2c(-c2cccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)c2)c2ccccc12.Cc1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1.c1cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1
InChIInChI=1S/C72H45N.C55H36.C23H17N/c1-3-19-48-41-54(37-35-46(48)17-1)71-63-31-9-10-32-64(63)72(55-38-36-47-18-2-4-20-49(47)42-55)66-45-51(39-40-65(66)71)50-21-15-22-52(43-50)69-59-27-5-7-29-61(59)70(62-30-8-6-28-60(62)69)53-23-16-24-56(44-53)73-67-33-13-11-25-57(67)58-26-12-14-34-68(58)73;1-35-45-19-6-8-21-47(45)53(48-22-9-7-20-46(35)48)42-18-12-17-40(33-42)41-29-30-51-52(34-41)55(44-28-26-37-14-3-5-16-39(37)32-44)50-24-11-10-23-49(50)54(51)43-27-25-36-13-2-4-15-38(36)31-43;1-16-10-11-18-15-19(13-12-17(18)14-16)24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24/h1-45H;2-34H,1H3;2-15H,1H3
InChIKeyKCDKSNHDGJODRP-UHFFFAOYSA-N
MW1928.45 g/mol
LogP41.87
Rot. Bonds11

About 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole

9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole (PubChem CID 159091690) has the molecular formula C150H98N2 and a molecular weight of 1928.45 g/mol. Its IUPAC name is 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole.

Molecular Properties

Compound Name9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole
PubChem CID159091690
Molecular FormulaC150H98N2
Molecular Weight1928.45 g/mol
Exact Mass1926.77
IUPAC Name9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole
SMILESCc1c2ccccc2c(-c2cccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)c2)c2ccccc12.Cc1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1.c1cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1
InChIInChI=1S/C72H45N.C55H36.C23H17N/c1-3-19-48-41-54(37-35-46(48)17-1)71-63-31-9-10-32-64(63)72(55-38-36-47-18-2-4-20-49(47)42-55)66-45-51(39-40-65(66)71)50-21-15-22-52(43-50)69-59-27-5-7-29-61(59)70(62-30-8-6-28-60(62)69)53-23-16-24-56(44-53)73-67-33-13-11-25-57(67)58-26-12-14-34-68(58)73;1-35-45-19-6-8-21-47(45)53(48-22-9-7-20-46(35)48)42-18-12-17-40(33-42)41-29-30-51-52(34-41)55(44-28-26-37-14-3-5-16-39(37)32-44)50-24-11-10-23-49(50)54(51)43-27-25-36-13-2-4-15-38(36)31-43;1-16-10-11-18-15-19(13-12-17(18)14-16)24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24/h1-45H;2-34H,1H3;2-15H,1H3
InChIKeyKCDKSNHDGJODRP-UHFFFAOYSA-N
XLogP41.87
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms152
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001928.45
LogP ≤ 541.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole?
The IUPAC name of 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole (CID 159091690) is 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole.
What is the SMILES notation for 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole?
The canonical SMILES for 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole is Cc1c2ccccc2c(-c2cccc(-c3ccc4c(-c5ccc6ccccc6c5)c5ccccc5c(-c5ccc6ccccc6c5)c4c3)c2)c2ccccc12.Cc1ccc2cc(-n3c4ccccc4c4ccccc43)ccc2c1.c1cc(-c2ccc3c(-c4ccc5ccccc5c4)c4ccccc4c(-c4ccc5ccccc5c4)c3c2)cc(-c2c3ccccc3c(-c3cccc(-n4c5ccccc5c5ccccc54)c3)c3ccccc23)c1.
What is the InChIKey of 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole?
The InChIKey is KCDKSNHDGJODRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C72H45N.C55H36.C23H17N/c1-3-19-48-41-54(37-35-46(48)17-1)71-63-31-9-10-32-64(63)72(55-38-36-47-18-2-4-20-49(47)42-55)66-45-51(39-40-65(66)71)50-21-15-22-52(43-50)69-59-27-5-7-29-61(59)70(62-30-8-6-28-60(62)69)53-23-16-24-56(44-53)73-67-33-13-11-25-57(67)58-26-12-14-34-68(58)73;1-35-45-19-6-8-21-47(45)53(48-22-9-7-20-46(35)48)42-18-12-17-40(33-42)41-29-30-51-52(34-41)55(44-28-26-37-14-3-5-16-39(37)32-44)50-24-11-10-23-49(50)54(51)43-27-25-36-13-2-4-15-38(36)31-43;1-16-10-11-18-15-19(13-12-17(18)14-16)24-22-8-4-2-6-20(22)21-7-3-5-9-23(21)24/h1-45H;2-34H,1H3;2-15H,1H3.
What are the key properties of 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole?
9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole has a molecular weight of 1928.45 g/mol, XLogP of 41.87, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[10-[3-(9,10-dinaphthalen-2-ylanthracen-2-yl)phenyl]anthracen-9-yl]phenyl]carbazole;2-[3-(10-methylanthracen-9-yl)phenyl]-9,10-dinaphthalen-2-ylanthracene;9-(6-methylnaphthalen-2-yl)carbazole is sourced from PubChem (CID 159091690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).