4-Chloro-5-nitro-2-(trifluoromethyl)pyridine, 95%

Name: 4-Chloro-5-nitro-2-(trifluoromethyl)pyridine
Brand: Chempure

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CAS Number

438554-45-1

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About this item

IUPAC name	4-chloro-5-nitro-2-(trifluoromethyl)pyridine
canonical smiles	C1=C(C(=CN=C1C(F)(F)F)[N+](=O)[O-])Cl
inchi	InChI=1S/C6H2ClF3N2O2/c7-3-1-5(6(8,9)10)11-2-4(3)12(13)14/h1-2H
inchi key	VBVLYVRVIUJULO-UHFFFAOYSA-N
molecular formula	C6H2ClF3N2O2
synonyms	4-Chloro-5-nitro-2-(trifluoromethyl)pyridine 438554-45-1 4-CHLORO-2-(TRIFLUOROMETHYL)-5-NITROPYRIDINE MFCD11848352 4-Chloro-5-nitro-2-trifluoromethylpyridine

Computed Properties

Molecular Weight:	226.54 g/mol
XLogP3:	2.2
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	6
Rotatable Bond Count:	0
Exact Mass:	225.9756895 g/mol
Monoisotopic Mass:	225.9756895 g/mol
Topological Polar Surface Area:	58.7 Å²
Heavy Atom Count:	14
Formal Charge:	0
Complexity:	230
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	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (100%)
precautionary statement codes	P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
hazard statements	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] H319 (100%): 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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*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: AA4542

4-Chloro-5-nitro-2-(trifluoromethyl)pyridine, 95%

Product No: AA4542

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Product No: AA4542

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?