2,4-dimethyl-9,9-diphenylfluorene

C27H22 — CID 144876512

IUPAC2,4-dimethyl-9,9-diphenylfluorene
SMILESCc1cc(C)c2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/C27H22/c1-19-17-20(2)26-23-15-9-10-16-24(23)27(25(26)18-19,21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-18H,1-2H3
InChIKeyDSDVXXJEQYYWGY-UHFFFAOYSA-N
MW346.47 g/mol
LogP6.67
Rot. Bonds2

About 2,4-dimethyl-9,9-diphenylfluorene

2,4-dimethyl-9,9-diphenylfluorene (PubChem CID 144876512) has the molecular formula C27H22 and a molecular weight of 346.47 g/mol. Its IUPAC name is 2,4-dimethyl-9,9-diphenylfluorene.

Molecular Properties

Compound Name2,4-dimethyl-9,9-diphenylfluorene
PubChem CID144876512
Molecular FormulaC27H22
Molecular Weight346.47 g/mol
Exact Mass346.17
IUPAC Name2,4-dimethyl-9,9-diphenylfluorene
SMILESCc1cc(C)c2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2
InChIInChI=1S/C27H22/c1-19-17-20(2)26-23-15-9-10-16-24(23)27(25(26)18-19,21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-18H,1-2H3
InChIKeyDSDVXXJEQYYWGY-UHFFFAOYSA-N
XLogP6.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.47
LogP ≤ 56.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-9,9-diphenylfluorene?
The IUPAC name of 2,4-dimethyl-9,9-diphenylfluorene (CID 144876512) is 2,4-dimethyl-9,9-diphenylfluorene.
What is the SMILES notation for 2,4-dimethyl-9,9-diphenylfluorene?
The canonical SMILES for 2,4-dimethyl-9,9-diphenylfluorene is Cc1cc(C)c2c(c1)C(c1ccccc1)(c1ccccc1)c1ccccc1-2.
What is the InChIKey of 2,4-dimethyl-9,9-diphenylfluorene?
The InChIKey is DSDVXXJEQYYWGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22/c1-19-17-20(2)26-23-15-9-10-16-24(23)27(25(26)18-19,21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-18H,1-2H3.
What are the key properties of 2,4-dimethyl-9,9-diphenylfluorene?
2,4-dimethyl-9,9-diphenylfluorene has a molecular weight of 346.47 g/mol, XLogP of 6.67, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-9,9-diphenylfluorene is sourced from PubChem (CID 144876512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).