2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene

C88H74O — CID 161049331

About 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene

2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene (PubChem CID 161049331) has the molecular formula C88H74O and a molecular weight of 1147.56 g/mol. Its IUPAC name is 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene.

Molecular Properties

• Compound Name: 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene
• PubChem CID: 161049331
• Molecular Formula: C88H74O
• Molecular Weight: 1147.56 g/mol
• Exact Mass: 1146.57
• IUPAC Name: 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene
• SMILES: CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)[C@@](C)(O)c3ccccc3-4)cc21.CC1c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21
• InChI: InChI=1S/C30H26.C29H24O.C29H24/c1-29(2)25-11-7-5-9-21(25)23-15-13-19(17-27(23)29)20-14-16-24-22-10-6-8-12-26(22)30(3,4)28(24)18-20;1-28(2)24-10-6-4-8-20(24)22-14-12-18(16-26(22)28)19-13-15-23-21-9-5-7-11-25(21)29(3,30)27(23)17-19;1-18-21-8-4-5-9-22(21)23-14-12-19(16-26(18)23)20-13-15-25-24-10-6-7-11-27(24)29(2,3)28(25)17-20/h5-18H,1-4H3;4-17,30H,1-3H3;4-18H,1-3H3/t;29-;/m.0./s1
• InChIKey: UBXPIGKJTOKXNH-USKPPXJHSA-N
• XLogP: 22.65
• TPSA: 20.23 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Rotatable Bonds: 3
• Heavy Atoms: 89
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1147.56
LogP ≤ 5	22.65
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene?

The IUPAC name of 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene (CID 161049331) is 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene.

What is the SMILES notation for 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene?

The canonical SMILES for 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)[C@@](C)(O)c3ccccc3-4)cc21.CC1c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3ccccc3-4)cc21.

What is the InChIKey of 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene?

The InChIKey is UBXPIGKJTOKXNH-USKPPXJHSA-N. The full InChI is InChI=1S/C30H26.C29H24O.C29H24/c1-29(2)25-11-7-5-9-21(25)23-15-13-19(17-27(23)29)20-14-16-24-22-10-6-8-12-26(22)30(3,4)28(24)18-20;1-28(2)24-10-6-4-8-20(24)22-14-12-18(16-26(22)28)19-13-15-23-21-9-5-7-11-25(21)29(3,30)27(23)17-19;1-18-21-8-4-5-9-22(21)23-14-12-19(16-26(18)23)20-13-15-25-24-10-6-7-11-27(24)29(2,3)28(25)17-20/h5-18H,1-4H3;4-17,30H,1-3H3;4-18H,1-3H3/t;29-;/m.0./s1.

What are the key properties of 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene?

2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene has a molecular weight of 1147.56 g/mol, XLogP of 22.65, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluorene;(9S)-2-(9,9-dimethylfluoren-2-yl)-9-methylfluoren-9-ol;9,9-dimethyl-2-(9-methyl-9H-fluoren-2-yl)fluorene is sourced from PubChem (CID 161049331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).