BDAF

• CAS: 854046-47-2
• Catalog Number: ACM854046472
• Category: Organic Light Emitting Diode (OLED)
• Molecular Weight: 690.91 g/mol
• Molecular Formula: C54H42
• Synonyms: 2-[9,9-Di(4-methylphenyl)-fluoren-2-yl]-9,9-di(4-methylphenyl)fluorene
• IUPAC Name: 2-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-bis(4-methylphenyl)fluorene
• Canonical SMILES: CC1=CC=C(C=C1)C2(C3=CC=CC=C3C4=C2C=C(C=C4)C5=CC6=C(C=C5)C7=CC=CC=C7C6(C8=CC=C(C=C8)C)C9=CC=C(C=C9)C)C1=CC=C(C=C1)C
• InChI Key: BIXGISJFDUHZEB-UHFFFAOYSA-N
• Density: 1.168
• Solubility: Toluene Chloroform
• Exact Mass: 690.32900
• Grade: Sublimed >97%
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• PL Peak: 386 nm (in THF)
• TGA: >310 ℃ (0.5% weight loss)
• UV Peak: 333 nm (in THF)

Custom Q&A

What is the molecular formula of the compound with PubChem CID 53401211?

The molecular formula is C54H42.

When was this compound created in PubChem?

It was created on 2011-10-30.

What is the IUPAC name of the compound?

The IUPAC name is 2-[9,9-bis(4-methylphenyl)fluoren-2-yl]-9,9-bis(4-methylphenyl)fluorene.

What is the InChIKey of the compound?

The InChIKey is BIXGISJFDUHZEB-UHFFFAOYSA-N.

What is the molecular weight of the compound?

The molecular weight is 690.9 g/mol.

How many rotatable bond counts does the compound have?

The compound has 5 rotatable bonds.

What is the exact mass of the compound?

The exact mass is 690.328651340 g/mol.

How many hydrogen bond donor counts does the compound have?

The compound has 0 hydrogen bond donor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

What is the XLogP3-AA value of the compound?

The XLogP3-AA value is 14.5.