What is the molecular formula of 1H-benzimidazole-5-boronic acid, pinacol ester?

The molecular formula is C13H17BN2O2.

What are the synonyms for 1H-benzimidazole-5-boronic acid, pinacol ester?

The synonyms include 1007206-54-3, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzo[d]imidazole, and 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazole.

What is the molecular weight of 1H-benzimidazole-5-boronic acid, pinacol ester?

The molecular weight is 244.10 g/mol.

What is the IUPAC name of 1H-benzimidazole-5-boronic acid, pinacol ester?

The IUPAC name is 6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazole.

What is the InChIKey of 1H-benzimidazole-5-boronic acid, pinacol ester?

The InChIKey is HCWNKNYTHLBIHX-UHFFFAOYSA-N.

What is the canonical SMILES of 1H-benzimidazole-5-boronic acid, pinacol ester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CN3.

What is the CAS number of 1H-benzimidazole-5-boronic acid, pinacol ester?

The CAS number is 1007206-54-3.

What is the molecular weight of 1H-benzimidazole-5-boronic acid, pinacol ester according to PubChem?

The molecular weight is 244.10 g/mol.

Is 1H-benzimidazole-5-boronic acid, pinacol ester considered as the canonicalized compound in PubChem?

Yes, it is considered as the canonicalized compound in PubChem.

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1H-benzimidazole-5-boronic acid, pinacol ester

Name: 1H-benzimidazole-5-boronic acid, pinacol ester
SKU: ACM1007206543-1
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Catalog NumberACM1007206543-1

CAS Number1007206-54-3

CategorySalt

1H-benzimidazole-5-boronic acid, pinacol ester

IUPAC Name

6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazole

Molecular Weight

244.1g/mol

Molecular Formula

C13H17BN2O2

Canonical SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C13H17BN2O2/c1-12(2)13(3,4)18-14(17-12)9-5-6-10-11(7-9)16-8-15-10/h5-8H,1-4H3,(H,15,16)

InChI Key

HCWNKNYTHLBIHX-UHFFFAOYSA-N

Complexity

319

Covalently-Bonded Unit Count

Exact Mass

244.138308g/mol

Formal Charge

Heavy Atom Count

Monoisotopic Mass

244.138308g/mol

Rotatable Bond Count

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