4-(Acetylaminomethyl)benzeneboronic acid

• Catalog Number: ACM850568411
• Product Name: 4-(Acetylaminomethyl)benzeneboronic acid
• CAS: 850568-41-1
• Category: Boro-Amino Acids
• Synonyms: 850568-41-1, 4-Acetamidomethylphenylboronic acid, 4-(Acetylaminomethyl)benzeneboronic acid, 4-(Acetamidomethyl)benzeneboronic acid, PubChem14580, ACMC-209q1x, SureCN101621, CTK5F3962, MolPort-001-760-781, 4-(acetamidomethyl)phenylboronic acid, ANW-38035, OR1333, AKOS006222262, AB26390, AG-H-41277, (4-(Acetamidomethyl)phenyl)boronic acid, AK-84332, KB-36123, (4-ACETAMIDOMETHYLPHENYL)BORONIC ACID, FT-0644937
• IUPAC Name: [4-(acetamidomethyl)phenyl]boronic acid
• Molecular Weight: 193.01
• Molecular Formula: C9H12BNO3
• Canonical SMILES: B(C1=CC=C(C=C1)CNC(=O)C)(O)O
• InChI Key: ZMJVNKSOLIUBKO-UHFFFAOYSA-N
• Melting Point: 278-280ºC
• Density: 1.19g/cm³
• Exact Mass: 193.09100
• H-Bond Acceptor: 3
• H-Bond Donor: 3

Custom Q&A

What is the molecular formula of 4-(Acetylaminomethyl)benzeneboronic acid?

The molecular formula of 4-(Acetylaminomethyl)benzeneboronic acid is C9H12BNO3.

What is the molecular weight of 4-(Acetylaminomethyl)benzeneboronic acid?

The molecular weight of 4-(Acetylaminomethyl)benzeneboronic acid is 193.01 g/mol.

What is the IUPAC name of 4-(Acetylaminomethyl)benzeneboronic acid?

The IUPAC name of 4-(Acetylaminomethyl)benzeneboronic acid is [4-(acetamidomethyl)phenyl]boronic acid.

What is the InChI of 4-(Acetylaminomethyl)benzeneboronic acid?

The InChI of 4-(Acetylaminomethyl)benzeneboronic acid is InChI=1S/C9H12BNO3/c1-7(12)11-6-8-2-4-9(5-3-8)10(13)14/h2-5,13-14H,6H2,1H3,(H,11,12).

What is the InChIKey of 4-(Acetylaminomethyl)benzeneboronic acid?

The InChIKey of 4-(Acetylaminomethyl)benzeneboronic acid is ZMJVNKSOLIUBKO-UHFFFAOYSA-N.

What is the canonical SMILES of 4-(Acetylaminomethyl)benzeneboronic acid?

The canonical SMILES of 4-(Acetylaminomethyl)benzeneboronic acid is B(C1=CC=C(C=C1)CNC(=O)C)(O)O.

What is the CAS number of 4-(Acetylaminomethyl)benzeneboronic acid?

The CAS number of 4-(Acetylaminomethyl)benzeneboronic acid is 850568-41-1.

What is the EC number of 4-(Acetylaminomethyl)benzeneboronic acid?

The EC number of 4-(Acetylaminomethyl)benzeneboronic acid is 695-699-8.

Is 4-(Acetylaminomethyl)benzeneboronic acid a canonicalized compound?

Yes, 4-(Acetylaminomethyl)benzeneboronic acid is canonicalized.