1,8-Dichloro-9,10-bis(phenylethynyl)anthracene

• CAS: 51749-83-8
• Catalog Number: ACM51749838
• Category: Organic & Printed Electronics
• Molecular Weight: 447.35
• Molecular Formula: C₃₀H₁₆Cl₂
• Synonyms: 9,10-BIS(PHENYLETHYNYL)-1,8-DICHLOROANTHRACENE;1,8-DICHLORO-9,10-BIS(PHENYLETHYNYL) ANTHRACENE;1,8-DICHLORO-BPEA;DBEA;1,8-DICHLORO-9,10-BIS(PHENYLETHYNYL) ANTHRACENE 99%;9,10-Bis(phenylethynl)-1,8-dichloroanthracene;1,8-Dichloro-9,10-bis(phenylethynyl)ant
• IUPAC Name: 1,8-dichloro-9,10-bis(2-phenylethynyl)anthracene
• Canonical SMILES: C1=CC=C(C=C1)C#CC2=C3C=CC=C(C3=C(C4=C2C=CC=C4Cl)C#CC5=CC=CC=C5)Cl
• InChI Key: YONGNHJIWAYNLC-UHFFFAOYSA-N
• Boiling Point: 658.4ºC at 760 mmHg
• Melting Point: 168-170ºC
• Flash Point: 345.8ºC
• Density: 1.35g/cm³
• Appearance: orange powder
• Exact Mass: 446.06300
• Hazard Statements: Xn:Harmful
• H-Bond Acceptor: 0
• H-Bond Donor: 0
• Safety Description: S26-S36/37/39-S45

Custom Q&A

What is the molecular formula of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The molecular formula is C30H16Cl2.

What is the PubChem CID of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The PubChem CID is 635032.

What is the molecular weight of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The molecular weight is 447.3 g/mol.

What is the IUPAC name of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The IUPAC name is 1,8-dichloro-9,10-bis(2-phenylethynyl)anthracene.

What is the InChI of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The InChI is InChI=1S/C30H16Cl2/c31-27-15-7-13-24-23(19-17-21-9-3-1-4-10-21)25-14-8-16-28(32)30(25)26(29(24)27)20-18-22-11-5-2-6-12-22/h1-16H.

What is the InChIKey of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The InChIKey is YONGNHJIWAYNLC-UHFFFAOYSA-N.

What is the canonical SMILES of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The canonical SMILES is C1=CC=C(C=C1)C#CC2=C3C=CC=C(C3=C(C4=C2C=CC=C4Cl)C#CC5=CC=CC=C5)Cl.

What is the CAS number of 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene?

The CAS number is 51749-83-8.

Is 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene a canonicalized compound?

Yes, 1,8-Dichloro-9,10-bis(phenylethynyl)anthracene is a canonicalized compound.