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Product No: BG2024

β-Bromo-4-nitrophenetole, >97.0%

Name: β-Bromo-4-nitrophenetole
Brand: Chempure

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CAS Number

13288-06-7

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About this item

IUPAC name	1-(2-bromoethoxy)-4-nitrobenzene
canonical smiles	C1=CC(=CC=C1[N+](=O)[O-])OCCBr
inchi	InChI=1S/C8H8BrNO3/c9-5-6-13-8-3-1-7(2-4-8)10(11)12/h1-4H,5-6H2
inchi key	YQWCBDNNEZHPMA-UHFFFAOYSA-N
molecular formula	C8H8BrNO3
synonyms	1-(2-Bromoethoxy)-4-nitrobenzene 13288-06-7 2-Bromoethyl 4-nitrophenyl Ether Benzene, 1-(2-bromoethoxy)-4-nitro- 2-Bromoethyl-4-nitrophenyl Ether

Computed Properties

Molecular Weight:	246.06 g/mol
XLogP3:	2.9
Hydrogen Bond Donor Count:	0
Hydrogen Bond Acceptor Count:	3
Rotatable Bond Count:	3
Exact Mass:	244.96876 g/mol
Monoisotopic Mass:	244.96876 g/mol
Topological Polar Surface Area:	55 Å²
Heavy Atom Count:	13
Formal Charge:	0
Complexity:	163
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

Related Compounds

4-Nitrophenol

p-Anisic acid

Methyl paraoxon

4-Nitroanisole

2-Nitronaphthalene

4-Nitrophenyl acetate

4-Nitrophenetole

2-Methyl-6-nitroquinoline

4-Ethoxybenzoic acid

Methyl 4-nitrobenzoate

1,2-Epoxy-3-(p-nitrophenoxy)propane

4-Nitropyridine N-oxide

4,4'-Dinitrodiphenyl ether

3-Methyl-4-nitroanisole

4-Nitrocinnamaldehyde

hazard signal	Warning
hazard classes and categories	Skin Irrit. 2 (100%) Eye Irrit. 2A (100%) STOT SE 3 (50%)
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 (50%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

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About this item

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: BG2024

β-Bromo-4-nitrophenetole, >97.0%

Product No: BG2024

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

About this item

Documentation

Certificate of Analysis

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Product No: BG2024

About this item

NAME AND IDENTIFIERS

CHEMICAL AND PHYSICAL PROPERTIES

Related Compounds

SAFETY AND HAZARDS

Require a Sample Certificate of Analysis (COA) ?