2-Fluorobiphenyl-4-carboxaldehyde

• CAS: 57592-43-5
• Catalog Number: ACM57592435
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 200.21
• Molecular Formula: C₇H₆F₃N
• Synonyms: 3-fluoro-4-phenylbenzaldehyde, 2-Fluorobiphenyl-4-carboxaldehyde, 57592-43-5, ACMC-20anuh, AC1MBZLN, 548057_ALDRICH, CTK5A7125, ZINC02548230, AKOS015912957, AG-G-03334, KB-31851, FT-0691683, I14-48912
• IUPAC Name: 3-fluoro-4-phenylbenzaldehyde
• SMILES: C1=CC=C(C=C1)C2=C(C=C(C=C2)C=O)F
• InChI Key: BBFKVFLWRKZSPM-UHFFFAOYSA-N
• Boiling Point: 315.8ºC at 760 mmHg
• Melting Point: 27-31ºC(lit.)
• Flash Point: >230ºC
• Density: 1.173g/cm³
• Exact Mass: 200.06400
• Hazard Statements: H301-H315-H319-H335
• H-Bond Acceptor: 2
• H-Bond Donor: 0
• RIDADR: NONH for all modes of transport
• Safety Description: 26-36/37
• Symbol: GHS06

Custom Q&A

What is the molecular formula of 2-Fluorobiphenyl-4-carboxaldehyde?

The molecular formula is C13H9FO.

What is the molecular weight of 2-Fluorobiphenyl-4-carboxaldehyde?

The molecular weight is 200.21 g/mol.

What is the IUPAC name of 2-Fluorobiphenyl-4-carboxaldehyde?

The IUPAC name is 3-fluoro-4-phenylbenzaldehyde.

What is the InChI of 2-Fluorobiphenyl-4-carboxaldehyde?

The InChI is InChI=1S/C13H9FO/c14-13-8-10(9-15)6-7-12(13)11-4-2-1-3-5-11/h1-9H.

What is the Canonical SMILES of 2-Fluorobiphenyl-4-carboxaldehyde?

The Canonical SMILES is C1=CC=C(C=C1)C2=C(C=C(C=C2)C=O)F.

What is the CAS number of 2-Fluorobiphenyl-4-carboxaldehyde?

The CAS number is 57592-43-5.

What is the European Community (EC) number of 2-Fluorobiphenyl-4-carboxaldehyde?

The EC number is 624-076-5.

What is the XLogP3 value of 2-Fluorobiphenyl-4-carboxaldehyde?

The XLogP3 value is 3.6.

How many hydrogen bond acceptor count does 2-Fluorobiphenyl-4-carboxaldehyde have?

It has 2 hydrogen bond acceptor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.