9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene

C30H28 — CID 143975231

IUPAC9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene
SMILESCC(Cc1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2
InChIInChI=1S/C30H28/c1-21(18-22-10-6-4-7-11-22)24-14-16-26-27-17-15-25(23-12-8-5-9-13-23)20-29(27)30(2,3)28(26)19-24/h4-17,19-21H,18H2,1-3H3
InChIKeyVDBSWUSEXXNGMY-UHFFFAOYSA-N
MW388.55 g/mol
LogP8.01
Rot. Bonds4

About 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene

9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene (PubChem CID 143975231) has the molecular formula C30H28 and a molecular weight of 388.55 g/mol. Its IUPAC name is 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene.

Molecular Properties

Compound Name9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene
PubChem CID143975231
Molecular FormulaC30H28
Molecular Weight388.55 g/mol
Exact Mass388.22
IUPAC Name9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene
SMILESCC(Cc1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2
InChIInChI=1S/C30H28/c1-21(18-22-10-6-4-7-11-22)24-14-16-26-27-17-15-25(23-12-8-5-9-13-23)20-29(27)30(2,3)28(26)19-24/h4-17,19-21H,18H2,1-3H3
InChIKeyVDBSWUSEXXNGMY-UHFFFAOYSA-N
XLogP8.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500388.55
LogP ≤ 58.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene?
The IUPAC name of 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene (CID 143975231) is 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene.
What is the SMILES notation for 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene?
The canonical SMILES for 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene is CC(Cc1ccccc1)c1ccc2c(c1)C(C)(C)c1cc(-c3ccccc3)ccc1-2.
What is the InChIKey of 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene?
The InChIKey is VDBSWUSEXXNGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H28/c1-21(18-22-10-6-4-7-11-22)24-14-16-26-27-17-15-25(23-12-8-5-9-13-23)20-29(27)30(2,3)28(26)19-24/h4-17,19-21H,18H2,1-3H3.
What are the key properties of 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene?
9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene has a molecular weight of 388.55 g/mol, XLogP of 8.01, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-dimethyl-2-phenyl-7-(1-phenylpropan-2-yl)fluorene is sourced from PubChem (CID 143975231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).