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Structure

6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester

CAS
1078575-71-9
Catalog Number
ACM1078575719
Category
Boronic Esters
Molecular Weight
235.09
Molecular Formula
C12H18BNO3

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Specification

Synonyms
1078575-71-9, (5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)METHANOL, SureCN2316680, CTK8B6503, ANW-53551, AKOS015999339, MB11485, QC-5253, AK-91890, BD230063, KB-208487, D-5207, 2-(HYDROXYMETHYL)PYRIDINE-5-BORONIC ACID, PINACOL ESTER, 6-(HYDROXYMETHYL)PYRIDIN-3-YLBORONIC ACID PINACOL ESTER
IUPAC Name
[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]methanol
InChI Key
XFCRCZYNRQHVDP-UHFFFAOYSA-N
Exact Mass
235.13800
H-Bond Acceptor
4
H-Bond Donor
1
What is the molecular formula of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The molecular formula is C12H18BNO3.

What is the synonyms of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The synonyms are 1078575-71-9, (5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)PYRIDIN-2-YL)METHANOL, [5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]methanol, 2-(HYDROXYMETHYL)PYRIDINE-5-BORONIC ACID, PINACOL ESTER, and 6-(Hydroxymethyl)pyridine-3-boronic acid pinacol ester.

What is the molecular weight of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The molecular weight is 235.09 g/mol.

What is the IUPAC name of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The IUPAC name is [5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-2-yl]methanol.

What is the InChI of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The InChI is InChI=1S/C12H18BNO3/c1-11(2)12(3,4)17-13(16-11)9-5-6-10(8-15)14-7-9/h5-7,15H,8H2,1-4H3.

What is the InChIKey of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The InChIKey is XFCRCZYNRQHVDP-UHFFFAOYSA-N.

What is the canonical SMILES of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The canonical SMILES is B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)CO.

What is the CAS number of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The CAS number is 1078575-71-9.

What is the DSSTox Substance ID of 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester?

The DSSTox Substance ID is DTXSID70726169.

Is 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester a canonicalized compound?

Yes, 6-(Hydroxymethyl)pyridine-3-boronicacidpinacolester is a canonicalized compound.

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