1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene

C132H120 — CID 158427752

IUPAC1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene
SMILESCc1cc(-c2ccccc2)cc2c1-c1ccccc1C2(C)C.Cc1ccc(-c2ccccc2)c2c1C(C)(C)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2.Cc1cccc2c1-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1cccc2c1C(C)(C)c1cc(-c3ccccc3)ccc1-2
InChIInChI=1S/6C22H20/c1-15-8-7-11-19-21(15)18-13-12-17(14-20(18)22(19,2)3)16-9-5-4-6-10-16;1-15-8-7-11-19-18-13-12-17(16-9-5-4-6-10-16)14-20(18)22(2,3)21(15)19;1-15-13-17(16-9-5-4-6-10-16)14-20-21(15)18-11-7-8-12-19(18)22(20,2)3;1-15-13-14-17(16-9-5-4-6-10-16)20-18-11-7-8-12-19(18)22(2,3)21(15)20;1-15-9-12-20-19(13-15)18-11-10-17(14-21(18)22(20,2)3)16-7-5-4-6-8-16;1-15-9-11-18-19-12-10-17(16-7-5-4-6-8-16)14-21(19)22(2,3)20(18)13-15/h6*4-14H,1-3H3
InChIKeyHBGNXCMNQFIFEZ-UHFFFAOYSA-N
MW1706.41 g/mol
LogP35.81
Rot. Bonds6

About 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene

1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene (PubChem CID 158427752) has the molecular formula C132H120 and a molecular weight of 1706.41 g/mol. Its IUPAC name is 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene.

Molecular Properties

Compound Name1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene
PubChem CID158427752
Molecular FormulaC132H120
Molecular Weight1706.41 g/mol
Exact Mass1704.94
IUPAC Name1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene
SMILESCc1cc(-c2ccccc2)cc2c1-c1ccccc1C2(C)C.Cc1ccc(-c2ccccc2)c2c1C(C)(C)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2.Cc1cccc2c1-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1cccc2c1C(C)(C)c1cc(-c3ccccc3)ccc1-2
InChIInChI=1S/6C22H20/c1-15-8-7-11-19-21(15)18-13-12-17(14-20(18)22(19,2)3)16-9-5-4-6-10-16;1-15-8-7-11-19-18-13-12-17(16-9-5-4-6-10-16)14-20(18)22(2,3)21(15)19;1-15-13-17(16-9-5-4-6-10-16)14-20-21(15)18-11-7-8-12-19(18)22(20,2)3;1-15-13-14-17(16-9-5-4-6-10-16)20-18-11-7-8-12-19(18)22(2,3)21(15)20;1-15-9-12-20-19(13-15)18-11-10-17(14-21(18)22(20,2)3)16-7-5-4-6-8-16;1-15-9-11-18-19-12-10-17(16-7-5-4-6-8-16)14-21(19)22(2,3)20(18)13-15/h6*4-14H,1-3H3
InChIKeyHBGNXCMNQFIFEZ-UHFFFAOYSA-N
XLogP35.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms132
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001706.41
LogP ≤ 535.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene?
The IUPAC name of 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene (CID 158427752) is 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene.
What is the SMILES notation for 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene?
The canonical SMILES for 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene is Cc1cc(-c2ccccc2)cc2c1-c1ccccc1C2(C)C.Cc1ccc(-c2ccccc2)c2c1C(C)(C)c1ccccc1-2.Cc1ccc2c(c1)-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2.Cc1cccc2c1-c1ccc(-c3ccccc3)cc1C2(C)C.Cc1cccc2c1C(C)(C)c1cc(-c3ccccc3)ccc1-2.
What is the InChIKey of 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene?
The InChIKey is HBGNXCMNQFIFEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/6C22H20/c1-15-8-7-11-19-21(15)18-13-12-17(14-20(18)22(19,2)3)16-9-5-4-6-10-16;1-15-8-7-11-19-18-13-12-17(16-9-5-4-6-10-16)14-20(18)22(2,3)21(15)19;1-15-13-17(16-9-5-4-6-10-16)14-20-21(15)18-11-7-8-12-19(18)22(20,2)3;1-15-13-14-17(16-9-5-4-6-10-16)20-18-11-7-8-12-19(18)22(2,3)21(15)20;1-15-9-12-20-19(13-15)18-11-10-17(14-21(18)22(20,2)3)16-7-5-4-6-8-16;1-15-9-11-18-19-12-10-17(16-7-5-4-6-8-16)14-21(19)22(2,3)20(18)13-15/h6*4-14H,1-3H3.
What are the key properties of 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene?
1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene has a molecular weight of 1706.41 g/mol, XLogP of 35.81, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,9,9-trimethyl-4-phenylfluorene;1,9,9-trimethyl-7-phenylfluorene;2,9,9-trimethyl-7-phenylfluorene;4,9,9-trimethyl-2-phenylfluorene;5,9,9-trimethyl-2-phenylfluorene;6,9,9-trimethyl-2-phenylfluorene is sourced from PubChem (CID 158427752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).