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Structure

3-Acetamido-5-carboxybenzeneboronic acid

CAS
108749-15-1
Catalog Number
ACM108749151
Category
Boronic Acids
Molecular Weight
222.991
Molecular Formula
C9H10 B N O5

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Specification

Synonyms
3-acetamido-5-boronobenzoic acid, 108749-15-1, 3-Acetamido-5-carboxybenzeneboronic acid, SureCN3450025, CHEMBL574842, CTK4A6178, MolPort-001-768-261, ACMC-209916, ACT11002, ANW-15976, OR3320, AKOS015837740, AG-D-25333, AK-84939, KB-29278, Benzoic acid,3-acetamido-5-borono- (6CI), 3-(dihydroxyboranyl)-5-acetamidobenzoic acid, FT-0687832, X1614, A-3608
IUPAC Name
3-acetamido-5-boronobenzoic acid
Canonical SMILES
B(C1=CC(=CC(=C1)NC(=O)C)C(=O)O)(O)O
InChI Key
JXYOFLNJWCEEBS-UHFFFAOYSA-N
Density
1.43g/cm³
Exact Mass
223.06500
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
5
H-Bond Donor
4
What is the molecular formula of 3-Acetamido-5-carboxybenzeneboronic acid?

The molecular formula is C9H10BNO5.

What is the synonym for 3-Acetamido-5-carboxybenzeneboronic acid?

The synonym is 3-acetamido-5-boronobenzoic acid.

What is the CAS number of 3-Acetamido-5-carboxybenzeneboronic acid?

The CAS number is 108749-15-1.

What is the IUPAC name of 3-Acetamido-5-carboxybenzeneboronic acid?

The IUPAC name is 3-acetamido-5-boronobenzoic acid.

What is the InChIKey of 3-Acetamido-5-carboxybenzeneboronic acid?

The InChIKey is JXYOFLNJWCEEBS-UHFFFAOYSA-N.

What is the molecular weight of 3-Acetamido-5-carboxybenzeneboronic acid?

The molecular weight is 222.99 g/mol.

How many hydrogen bond donor counts does 3-Acetamido-5-carboxybenzeneboronic acid have?

It has 4 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does 3-Acetamido-5-carboxybenzeneboronic acid have?

It has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does 3-Acetamido-5-carboxybenzeneboronic acid have?

It has 3 rotatable bond counts.

What is the exact mass of 3-Acetamido-5-carboxybenzeneboronic acid?

The exact mass is 223.0652026 g/mol.

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