5-BROMO-2-CYANOPYRIDINE, >97%

Name: 5-BROMO-2-CYANOPYRIDINE
Brand: Chempure
Rating: 4 (1 reviews)

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CAS Number

97483-77-7

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About this item

IUPAC name	5-bromopyridine-2-carbonitrile
canonical smiles	C1=CC(=NC=C1Br)C#N
inchi	InChI=1S/C6H3BrN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H
inchi key	DMSHUVBQFSNBBL-UHFFFAOYSA-N
molecular formula	C6H3BrN2
synonyms	5-Bromo-2-Cyanopyridine 97483-77-7 5-bromopicolinonitrile 5-Bromo-2-pyridinecarbonitrile 5-bromopyridine-2-carbonitrile

Computed Properties

Molecular Weight:	183.01 g/mol
XLogP3:	1.6
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	2
Rotatable Bond Count:	0
Exact Mass:	181.94796 g/mol
Monoisotopic Mass:	181.94796 g/mol
Topological Polar Surface Area:	36.7 Å²
Heavy Atom Count:	9
Formal Charge:	0
Complexity:	137
Isotope Atom Count:	0
Defined Atom Stereocenter Count:	0
Undefined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
Covalently-Bonded Unit Count:	1
Compound Is Canonicalized:	Yes

hazard signal	Danger
hazard classes and categories	Acute Tox. 3 (89.58%) Skin Irrit. 2 (100%) Eye Dam. 1 (81.25%) Eye Irrit. 2 (18.75%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H301 (89.58%): Toxic if swallowed [Danger Acute toxicity, oral] H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H318 (81.25%): Causes serious eye damage [Danger Serious eye damage/eye irritation] H319 (18.75%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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Documentation

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*This document is like a lab demo—an example Certificate of Analysis (COA) that showcases what a COA looks like but may not match the latest batch in all its glory. Think of it as a chemistry experiment: close, but not quite the final reaction!

Product No: CT9385

5-BROMO-2-CYANOPYRIDINE, >97%

Product No: CT9385

About this item

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CHEMICAL AND PHYSICAL PROPERTIES

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Certificate of Analysis

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Product No: CT9385

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?