4-Bromobenzotriazole - CAS 1064721-11-4

Catalog:	BB001875
Product Name:	4-Bromobenzotriazole
CAS:	1064721-11-4
Synonyms:	4-bromo-2H-benzotriazole; 4-bromo-2H-benzotriazole

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	4-bromo-2H-benzotriazole
Description:	4-Bromobenzotriazole (CAS# 1064721-11-4) is a useful research chemical.
Molecular Weight:	198.02
Molecular Formula:	C6H4BrN3
Canonical SMILES:	C1=CC2=NNN=C2C(=C1)Br
InChI:	InChI=1S/C6H4BrN3/c7-4-2-1-3-5-6(4)9-10-8-5/h1-3H,(H,8,9,10)
InChI Key:	DNJANJSHTMOQOV-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	1.72040

Publication Number	Title	Priority Date
WO-2021153122-A1	Treatment solution and method for treating treatment object	20200128
CN-110963975-A	Benzotriazole derivative, preparation method and application of benzotriazole derivative as bactericide	20191118
US-2021071078-A1	Etching composition	20190910
WO-2021050333-A1	Etching composition	20190910
WO-2021049208-A1	Treatment liquid, kit, treatment liquid production method, substrate cleaning method, and substrate treatment method	20190909

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Related Functional Groups

Arenes

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1-Phenyl-1H-pyrazol-4-amine hydrochloride

Benzotriazoles

[937013-96-2]
4-Bromo-6-fluoro-1H-benzo[d][1,2,3]triazole
[1082951-62-9]
HDMC
[21050-95-3]
1-Chlorobenzotriazole
[36437-37-3]
2-(2H-Benzotriazol-2-yl)-4-(tert-butyl)-6-(sec-butyl)phenol
[13183-01-2]
3-Methylbenzotriazol-4-amine
[1064721-11-4]
4-Bromobenzotriazole

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; 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, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	196.95886
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	196.95886
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7