9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene

C34H24 — CID 20822440

IUPAC9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene
SMILESCC1c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc21
InChIInChI=1S/C34H24/c1-22-25-13-5-6-14-26(25)27-20-19-24(21-32(22)27)34-30-17-9-7-15-28(30)33(23-11-3-2-4-12-23)29-16-8-10-18-31(29)34/h2-22H,1H3
InChIKeyWJLGYUDPIYEQKE-UHFFFAOYSA-N
MW432.57 g/mol
LogP9.46
Rot. Bonds2

About 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene

9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene (PubChem CID 20822440) has the molecular formula C34H24 and a molecular weight of 432.57 g/mol. Its IUPAC name is 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene.

Molecular Properties

Compound Name9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene
PubChem CID20822440
Molecular FormulaC34H24
Molecular Weight432.57 g/mol
Exact Mass432.19
IUPAC Name9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene
SMILESCC1c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc21
InChIInChI=1S/C34H24/c1-22-25-13-5-6-14-26(25)27-20-19-24(21-32(22)27)34-30-17-9-7-15-28(30)33(23-11-3-2-4-12-23)29-16-8-10-18-31(29)34/h2-22H,1H3
InChIKeyWJLGYUDPIYEQKE-UHFFFAOYSA-N
XLogP9.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms34
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.57
LogP ≤ 59.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene?
The IUPAC name of 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene (CID 20822440) is 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene.
What is the SMILES notation for 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene?
The canonical SMILES for 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene is CC1c2ccccc2-c2ccc(-c3c4ccccc4c(-c4ccccc4)c4ccccc34)cc21.
What is the InChIKey of 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene?
The InChIKey is WJLGYUDPIYEQKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H24/c1-22-25-13-5-6-14-26(25)27-20-19-24(21-32(22)27)34-30-17-9-7-15-28(30)33(23-11-3-2-4-12-23)29-16-8-10-18-31(29)34/h2-22H,1H3.
What are the key properties of 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene?
9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene has a molecular weight of 432.57 g/mol, XLogP of 9.46, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(9-methyl-9H-fluoren-2-yl)-10-phenylanthracene is sourced from PubChem (CID 20822440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).