2-Bromoisonicotinamide

• CAS: 29840-73-1
• Catalog Number: ACM29840731
• Category: Bromine Series
• Molecular Weight: 201.02
• Molecular Formula: C₆H₅BrN₂O
• Synonyms: Ambad96, 2-bromoisonicotinamide, 2-Bromo-isonicotinamide, 2-Bromopyridine-4-carboxamide, ZINC02559905, AC-907/25004500, 29840-73-1
• IUPAC Name: 2-bromopyridine-4-carboxamide
• Canonical SMILES: C1=CN=C(C=C1C(=O)N)Br
• InChI Key: KCELTDZFDHPTBI-UHFFFAOYSA-N
• Boiling Point: 338.1ºC at 760 mmHg
• Melting Point: 192ºC
• Flash Point: 158.3ºC
• Density: 1.71 g/cm³
• Exact Mass: 199.95900
• Hazard Statements: Xi: Irritant
• H-Bond Acceptor: 2
• H-Bond Donor: 1
• Safety Description: S26-S36

Custom Q&A

What is the molecular formula of 2-Bromoisonicotinamide?

The molecular formula of 2-Bromoisonicotinamide is C6H5BrN2O.

What is the molecular weight of 2-Bromoisonicotinamide?

The molecular weight of 2-Bromoisonicotinamide is 201.02 g/mol.

What is the IUPAC name of 2-Bromoisonicotinamide?

The IUPAC name of 2-Bromoisonicotinamide is 2-bromopyridine-4-carboxamide.

What is the InChI of 2-Bromoisonicotinamide?

The InChI of 2-Bromoisonicotinamide is InChI=1S/C6H5BrN2O/c7-5-3-4(6(8)10)1-2-9-5/h1-3H,(H2,8,10).

What is the InChIKey of 2-Bromoisonicotinamide?

The InChIKey of 2-Bromoisonicotinamide is KCELTDZFDHPTBI-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Bromoisonicotinamide?

The canonical SMILES of 2-Bromoisonicotinamide is C1=CN=C(C=C1C(=O)N)Br.

What is the CAS number of 2-Bromoisonicotinamide?

The CAS number of 2-Bromoisonicotinamide is 29840-73-1.

What is the XLogP3 value of 2-Bromoisonicotinamide?

The XLogP3 value of 2-Bromoisonicotinamide is 0.6.

How many hydrogen bond donor counts does 2-Bromoisonicotinamide have?

2-Bromoisonicotinamide has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does 2-Bromoisonicotinamide have?

2-Bromoisonicotinamide has 2 hydrogen bond acceptor counts.