2-Bromo-5-chloroanisole - CAS 174913-09-8

Name: 2-Bromo-5-chloroanisole
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB013060
Product Name:	2-Bromo-5-chloroanisole
CAS:	174913-09-8
Synonyms:	1-bromo-4-chloro-2-methoxybenzene; 1-bromo-4-chloro-2-methoxybenzene

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	1-bromo-4-chloro-2-methoxybenzene
Description:	2-Bromo-5-chloroanisole (CAS# 174913-09-8) is a useful research chemical.
Molecular Weight:	221.48
Molecular Formula:	C7H6BrClO
Canonical SMILES:	COC1=C(C=CC(=C1)Cl)Br
InChI:	InChI=1S/C7H6BrClO/c1-10-7-4-5(9)2-3-6(7)8/h2-4H,1H3
InChI Key:	CQGYLDZGJLVLMK-UHFFFAOYSA-N
Boiling Point:	236.6 °C at 760 mmHg
Density:	1.564 g/cm³
MDL:	MFCD03790889
LogP:	3.11110

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Related Functional Groups

Halides

[859473-05-5]C9H6Cl2N2S
N-(3,4-Dichlorophenyl)-1,3-thiazol-2-amine
[1225940-17-9]C11H9ClF3N3
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[1448610-48-7]C11H13BrO
1-(4-Bromo-3-methylphenyl)cyclobutanol
[333311-69-6]C12H12BrN3O2
1-(4-Bromobenzyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[51355-91-0]C6H8ClN3O2
1-(Chloromethyl)-3,5-dimethyl-4-nitro-1H-pyrazole
[102388-00-1]C4H4ClN3O2
1-(Chloromethyl)-3-nitro-1H-pyrazole

GHS Hazard Statement:	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]
Precautionary Statement:	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
Signal Word:	Warning

Publication Number	Title	Priority Date
CN-111377853-A	Nitrogen-containing compound, electronic component, and electronic device	20191227
CN-111377853-B	Nitrogen-containing compound, electronic component, and electronic device	20191227
WO-2021128764-A1	Nitrogen-containing compound, electronic element, and electronic device	20191227
WO-2020163375-A1	Methods and compositions for modulating splicing	20190204
CN-111138418-A	Organic heterocyclic compound, application thereof and organic electroluminescent device	20181102

Complexity:	110
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	219.92906
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	219.92906
Rotatable Bond Count:	1
Topological Polar Surface Area:	9.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4