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Structure

2-Aminocarbonylphenylboronic acid

CAS
380430-54-6
Catalog Number
ACM380430546
Category
Boronic Acids
Molecular Weight
164.95
Molecular Formula
C7H8BNO3

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Specification

Synonyms
(2-AMINOCARBONYL)BENZENEBORONIC ACID;2-AMINOCARBONYLPHENYLBORONIC ACID;2-CARBAMOYLPHENYLBORONIC ACID;2-Carbamoylboronic acid;Boronic acid, [2-(aminocarbonyl)phenyl]- (9CI);2-Aminocarbonyiphenylboronic acid;2-(Aminocarbonyl)benzeneboronic acid 96%;2-Carbam
IUPAC Name
(2-carbamoylphenyl)boronic acid
Canonical SMILES
B(C1=CC=CC=C1C(=O)N)(O)O
InChI Key
LBWJTKOVBMVJJX-UHFFFAOYSA-N
Boiling Point
410.3ºC at 760 mmHg
Melting Point
226-230ºC
Flash Point
201.9ºC
Density
1.32 g/cm³
Exact Mass
165.06000
H-Bond Acceptor
3
H-Bond Donor
3
Safety Description
26-36/37/39
What is the molecular formula of 2-Aminocarbonylphenylboronic acid?

The molecular formula of 2-Aminocarbonylphenylboronic acid is C7H8BNO3.

What is the molecular weight of 2-Aminocarbonylphenylboronic acid?

The molecular weight of 2-Aminocarbonylphenylboronic acid is 164.96 g/mol.

What is the IUPAC name of 2-Aminocarbonylphenylboronic acid?

The IUPAC name of 2-Aminocarbonylphenylboronic acid is (2-carbamoylphenyl)boronic acid.

What is the InChI code of 2-Aminocarbonylphenylboronic acid?

The InChI code of 2-Aminocarbonylphenylboronic acid is InChI=1S/C7H8BNO3/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4,11-12H,(H2,9,10).

What is the InChIKey of 2-Aminocarbonylphenylboronic acid?

The InChIKey of 2-Aminocarbonylphenylboronic acid is LBWJTKOVBMVJJX-UHFFFAOYSA-N.

What is the canonical SMILES of 2-Aminocarbonylphenylboronic acid?

The canonical SMILES of 2-Aminocarbonylphenylboronic acid is B(C1=CC=CC=C1C(=O)N)(O)O.

What is the CAS number of 2-Aminocarbonylphenylboronic acid?

The CAS number of 2-Aminocarbonylphenylboronic acid is 380430-54-6.

What is the European Community (EC) number of 2-Aminocarbonylphenylboronic acid?

The European Community (EC) number of 2-Aminocarbonylphenylboronic acid is 800-713-4.

What is the hydrogen bond donor count of 2-Aminocarbonylphenylboronic acid?

The hydrogen bond donor count of 2-Aminocarbonylphenylboronic acid is 3.

Is 2-Aminocarbonylphenylboronic acid a canonicalized compound?

Yes, 2-Aminocarbonylphenylboronic acid is a canonicalized compound.

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