Structure

Indazole-4-boronic acid

CAS
1023595-17-6
Catalog Number
ACM1023595176
Category
Boronic Acids
Molecular Weight
161.96
Molecular Formula
C7H7BN2O2

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Specification

Synonyms
1023595-17-6, 1H-Indazole-4-boronic acid, (1H-Indazol-4-yl)boronic acid, 1H-indazol-4-ylboronic acid, 4-Borono-1H-indazole, Indazole-4-boronic acid, 1H-Indazol-4-boronic acid, 1H-INDAZOL-4-YL-4-BORONIC ACID, SureCN87679, Indazole-4-boronic acid,, 1H-Indazol-4-yl-boronic acid, ACMC-20981m, CTK8A9035, ANW-14696, BORONIC ACID, INDAZOL-4-YL-, AKOS005258550, OR60110, PB20443, RP02197, B-1H-INDAZOL-4-YL-BORONIC ACID
IUPAC Name
1H-indazol-4-ylboronic acid
Canonical SMILES
B(C1=C2C=NNC2=CC=C1)(O)O
InChI Key
BGZZJZIZRARGGZ-UHFFFAOYSA-N
Boiling Point
457.012ºC at 760 mmHg
Flash Point
230.193ºC
Density
1.423 g/cm³
Exact Mass
162.06000
H-Bond Acceptor
3
H-Bond Donor
3
What is the molecular formula of Indazole-4-boronic acid?

The molecular formula of Indazole-4-boronic acid is C7H7BN2O2.

What is the molecular weight of Indazole-4-boronic acid?

The molecular weight of Indazole-4-boronic acid is 161.96 g/mol.

What is the IUPAC name of Indazole-4-boronic acid?

The IUPAC name of Indazole-4-boronic acid is 1H-indazol-4-ylboronic acid.

What is the InChI of Indazole-4-boronic acid?

The InChI of Indazole-4-boronic acid is InChI=1S/C7H7BN2O2/c11-8(12)6-2-1-3-7-5(6)4-9-10-7/h1-4,11-12H,(H,9,10).

What is the InChIKey of Indazole-4-boronic acid?

The InChIKey of Indazole-4-boronic acid is BGZZJZIZRARGGZ-UHFFFAOYSA-N.

What is the canonical SMILES of Indazole-4-boronic acid?

The canonical SMILES of Indazole-4-boronic acid is B(C1=C2C=NNC2=CC=C1)(O)O.

What is the CAS number of Indazole-4-boronic acid?

The CAS number of Indazole-4-boronic acid is 1023595-17-6.

What is the EC number of Indazole-4-boronic acid?

The EC number of Indazole-4-boronic acid is 687-280-3.

What is the monoisotopic mass of Indazole-4-boronic acid?

The monoisotopic mass of Indazole-4-boronic acid is 162.0600576 g/mol.

Is Indazole-4-boronic acid a canonicalized compound?

Yes, Indazole-4-boronic acid is a canonicalized compound.

Downstream Synthesis Route 1

  • 1023595-17-6
  • 1137278-38-6

Reference: [1]Patent: WO2009/42607,2009,A1 .Location in patent: Page/Page column 98-99

Downstream Synthesis Route 2

  • 1023595-17-6
  • 1137278-66-0
  • 1137278-15-9

Reference: [1]Patent: WO2009/42607,2009,A1 .Location in patent: Page/Page column 91

* For details of the synthesis route, please refer to the original source to ensure accuracy.

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