2-(Bromomethyl)phenylboronic Acid - CAS 91983-14-1

Name: 2-(Bromomethyl)phenylboronic Acid
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB040402
Product Name:	2-(Bromomethyl)phenylboronic Acid
CAS:	91983-14-1
Synonyms:	[2-(bromomethyl)phenyl]boronic acid; [2-(bromomethyl)phenyl]boronic acid

Technical Data

IUPAC Name:	[2-(bromomethyl)phenyl]boronic acid
Description:	2-(Bromomethyl)phenylboronic acid can be used as a reactant to synthesize: Boronic acid-functionalized benzyl viologen (o-BBV) from 4,4'-bipyridine. o-BBV finds its application as a chemosensor to sense glucose in aqueous water; 2-(azidomethyl)phenylboronic acid, which is further employed in the preparation of isoquinoline derivatives.; Aryl boronic acid derivatives as fluorescent probe for hydrogen peroxide detection. Reactant involved in: Studies of carbon-boron bond cleavage of phenylboronate-pendant cyclen; Development of a sensory system to detect glucose or other monosaccharides and hydroxycarboxylates; Synthesis of boronated triaryl and tetraaryl phosphonium salts used in cytotoxicity studies; Colorimetry and fluorometry mercury determination with chemosensors composed of rhodamine and boronic acid groups; Synthesis of imidazolium-containing boronic acids used as fluoride ion sensors; Reactions with adenine for molecules with antiinflammatory antitumor activities.
Molecular Weight:	214.85
Molecular Formula:	C7H8BrO2B
Canonical SMILES:	B(C1=CC=CC=C1CBr)(O)O
InChI:	InChI=1S/C7H8BBrO2/c9-5-6-3-1-2-4-7(6)8(10)11/h1-4,10-11H,5H2
InChI Key:	MYVJCOQGXCONPE-UHFFFAOYSA-N
Boiling Point:	358.5 °C at 760 mmHg
Melting Point:	158-162 °C
Flash Point:	Not applicable
Density:	1.57 g/cm³
Storage:	2-8 °C
MDL:	MFCD01318941
LogP:	0.26130

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

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Complexity:	121
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	213.98007
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	213.98007
Rotatable Bond Count:	2
Topological Polar Surface Area:	40.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0