2-Amino-5-fluorobenzonitrile

• CAS: 61272-77-3
• Catalog Number: ACM61272773
• Category: Aryl Fluorinated Building Blocks
• Molecular Weight: 136.13
• Molecular Formula: C7H5FN2
• Synonyms: Benzonitrile, 2-amino-5-fluoro-
• IUPAC Name: 2-amino-5-fluorobenzonitrile
• Canonical SMILES: C1=CC(=C(C=C1F)C#N)N
• InChI: InChI=1S/C7H5FN2/c8-6-1-2-7(10)5(3-6)4-9/h1-3H,10H2
• InChI Key: VFQDFQDXMNVDPW-UHFFFAOYSA-N
• Boiling Point: 138 °C 15mmHg
• Melting Point: 92-96 °C
• Density: 1.25±0.1 g/ml
• Hazard Statements: H302
• RIDADR: UN 1989C 3 / PGIII
• Symbol: GHS07

Custom Q&A

What is the molecular formula of 2-Amino-5-fluorobenzonitrile?

The molecular formula is C7H5FN2.

When was 2-Amino-5-fluorobenzonitrile first created in the database?

It was created on July 19, 2005.

What is the molecular weight of 2-Amino-5-fluorobenzonitrile?

The molecular weight is 136.13 g/mol.

What is the InChIKey of 2-Amino-5-fluorobenzonitrile?

The InChIKey is VFQDFQDXMNVDPW-UHFFFAOYSA-N.

How many hydrogen bond donor counts does 2-Amino-5-fluorobenzonitrile have?

It has 1 hydrogen bond donor count.

What is the exact mass of 2-Amino-5-fluorobenzonitrile?

The exact mass is 136.04367633 g/mol.

How many heavy atoms are present in 2-Amino-5-fluorobenzonitrile?

There are 10 heavy atoms present.

Is 2-Amino-5-fluorobenzonitrile a canonicalized compound?

Yes, it is a canonicalized compound.

What is the topological polar surface area of 2-Amino-5-fluorobenzonitrile?

The topological polar surface area is 49.8 Ų.

How many rotatable bond counts does 2-Amino-5-fluorobenzonitrile have?

It has 0 rotatable bond counts.