2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene

C116H144 — CID 21028072

About 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene

2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene (PubChem CID 21028072) has the molecular formula C116H144 and a molecular weight of 1538.43 g/mol. Its IUPAC name is 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene.

Molecular Properties

• Compound Name: 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene
• PubChem CID: 21028072
• Molecular Formula: C116H144
• Molecular Weight: 1538.43 g/mol
• Exact Mass: 1537.13
• IUPAC Name: 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene
• SMILES: CCC(C)CC1(CC(C)CC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(CC(C)CC)(CC(C)CC)c3cc(-c5ccc6c(c5)C(CC(C)CC)(CC(C)CC)c5cc(-c7ccc8c(c7)C(CC(C)CC)(CC(C)CC)c7cc(-c9ccc%10c(c9)C(CC(C)CC)(CC(C)CC)c9cc(C)ccc9-%10)ccc7-8)ccc5-6)ccc3-4)cc21
• InChI: InChI=1S/C116H144/c1-22-73(11)63-112(64-74(12)23-2)102-35-33-32-34-92(102)94-46-37-84(55-104(94)112)86-39-48-96-98-50-41-88(59-108(98)114(106(96)57-86,67-77(15)26-5)68-78(16)27-6)90-43-52-100-101-53-44-91(62-111(101)116(110(100)61-90,71-81(19)30-9)72-82(20)31-10)89-42-51-99-97-49-40-87(58-107(97)115(109(99)60-89,69-79(17)28-7)70-80(18)29-8)85-38-47-95-93-45-36-83(21)54-103(93)113(105(95)56-85,65-75(13)24-3)66-76(14)25-4/h32-62,73-82H,22-31,63-72H2,1-21H3
• InChIKey: CQZNHDKAJGDNOH-UHFFFAOYSA-N
• XLogP: 34.36
• TPSA: 0.00 Ų
• Rotatable Bonds: 34
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1538.43
LogP ≤ 5	34.36
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	0

Frequently Asked Questions

What is the IUPAC name of 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene?

The IUPAC name of 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene (CID 21028072) is 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene.

What is the SMILES notation for 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene?

The canonical SMILES for 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene is CCC(C)CC1(CC(C)CC)c2ccccc2-c2ccc(-c3ccc4c(c3)C(CC(C)CC)(CC(C)CC)c3cc(-c5ccc6c(c5)C(CC(C)CC)(CC(C)CC)c5cc(-c7ccc8c(c7)C(CC(C)CC)(CC(C)CC)c7cc(-c9ccc%10c(c9)C(CC(C)CC)(CC(C)CC)c9cc(C)ccc9-%10)ccc7-8)ccc5-6)ccc3-4)cc21.

What is the InChIKey of 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene?

The InChIKey is CQZNHDKAJGDNOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C116H144/c1-22-73(11)63-112(64-74(12)23-2)102-35-33-32-34-92(102)94-46-37-84(55-104(94)112)86-39-48-96-98-50-41-88(59-108(98)114(106(96)57-86,67-77(15)26-5)68-78(16)27-6)90-43-52-100-101-53-44-91(62-111(101)116(110(100)61-90,71-81(19)30-9)72-82(20)31-10)89-42-51-99-97-49-40-87(58-107(97)115(109(99)60-89,69-79(17)28-7)70-80(18)29-8)85-38-47-95-93-45-36-83(21)54-103(93)113(105(95)56-85,65-75(13)24-3)66-76(14)25-4/h32-62,73-82H,22-31,63-72H2,1-21H3.

What are the key properties of 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene?

2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene has a molecular weight of 1538.43 g/mol, XLogP of 34.36, 34 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[9,9-bis(2-methylbutyl)fluoren-2-yl]-7-[7-[7-[7-methyl-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluoren-2-yl]-9,9-bis(2-methylbutyl)fluorene is sourced from PubChem (CID 21028072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).