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685194

Sigma-Aldrich

2-Methyl-4-cyanophenylboronic acid

≥95%

Synonym(s):

(4-Cyano-2-methylphenyl)boronic acid

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About This Item

Empirical Formula (Hill Notation):
C8H8BNO2
CAS Number:
313546-18-8
Molecular Weight:
160.97
MDL number:
MFCD09750473
UNSPSC Code:
12352103
PubChem Substance ID:
24885836
NACRES:
NA.22

Assay

≥95%

form

solid

mp

287-305 °C

SMILES string

Cc1cc(ccc1B(O)O)C#N

InChI

1S/C8H8BNO2/c1-6-4-7(5-10)2-3-8(6)9(11)12/h2-4,11-12H,1H3

InChI key

RGCVYEOTYJCNOS-UHFFFAOYSA-N

Related Categories

General description

May contain varying amounts of anhydride.

Application

Reactant involved in:
  • Reactions with (cyanomethylphenyl)boronic acid
  • Synthesis of oligo-boronic acid receptors with improved structural and electronic properties
  • Syntesis of aminoalkoxybiphenylnitriles for use as histamine-3 receptor ligands

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

PDSCL

Deleterious substance

PRTR

Class I Designated Chemical Substances

JAN Code

685194-1G:4548173288093
685194-5G:4548173288109
685194-BULK:
685194-VAR:

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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