9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane

C30H30 — CID 142961405

IUPAC9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane
SMILESCCC.Cc1ccccc1-c1ccccc1C1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C27H22.C3H8/c1-19-11-3-4-12-20(19)21-13-5-8-16-24(21)27(2)25-17-9-6-14-22(25)23-15-7-10-18-26(23)27;1-3-2/h3-18H,1-2H3;3H2,1-2H3
InChIKeyKSZLUCYGWXAFPC-UHFFFAOYSA-N
MW390.57 g/mol
LogP8.41
Rot. Bonds2

About 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane

9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane (PubChem CID 142961405) has the molecular formula C30H30 and a molecular weight of 390.57 g/mol. Its IUPAC name is 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane.

Molecular Properties

Compound Name9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane
PubChem CID142961405
Molecular FormulaC30H30
Molecular Weight390.57 g/mol
Exact Mass390.23
IUPAC Name9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane
SMILESCCC.Cc1ccccc1-c1ccccc1C1(C)c2ccccc2-c2ccccc21
InChIInChI=1S/C27H22.C3H8/c1-19-11-3-4-12-20(19)21-13-5-8-16-24(21)27(2)25-17-9-6-14-22(25)23-15-7-10-18-26(23)27;1-3-2/h3-18H,1-2H3;3H2,1-2H3
InChIKeyKSZLUCYGWXAFPC-UHFFFAOYSA-N
XLogP8.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms30
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.57
LogP ≤ 58.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane?
The IUPAC name of 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane (CID 142961405) is 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane.
What is the SMILES notation for 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane?
The canonical SMILES for 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane is CCC.Cc1ccccc1-c1ccccc1C1(C)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane?
The InChIKey is KSZLUCYGWXAFPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22.C3H8/c1-19-11-3-4-12-20(19)21-13-5-8-16-24(21)27(2)25-17-9-6-14-22(25)23-15-7-10-18-26(23)27;1-3-2/h3-18H,1-2H3;3H2,1-2H3.
What are the key properties of 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane?
9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane has a molecular weight of 390.57 g/mol, XLogP of 8.41, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-[2-(2-methylphenyl)phenyl]fluorene;propane is sourced from PubChem (CID 142961405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).