1-(3-Bromophenyl)-1,2,4-triazole - CAS 375857-96-8

Catalog:	BB023348
Product Name:	1-(3-Bromophenyl)-1,2,4-triazole
CAS:	375857-96-8
Synonyms:	1-(3-bromophenyl)-1,2,4-triazole; 1-(3-bromophenyl)-1,2,4-triazole

Technical Data

Patents

Computed Properties

IUPAC Name:	1-(3-bromophenyl)-1,2,4-triazole
Description:	1-(3-Bromophenyl)-1,2,4-triazole (CAS# 375857-96-8 ) is a useful research chemical.
Molecular Weight:	224.06
Molecular Formula:	C8H6BrN3
Canonical SMILES:	C1=CC(=CC(=C1)Br)N2C=NC=N2
InChI:	InChI=1S/C8H6BrN3/c9-7-2-1-3-8(4-7)12-6-10-5-11-12/h1-6H
InChI Key:	YJQBLWWHFYAXRA-UHFFFAOYSA-N
LogP:	2.02980

Publication Number	Title	Priority Date
CN-110452689-A	A kind of electroluminescent organic material and organic electroluminescence device based on Triazolopyridine	20190822
CN-112300124-A	Organic electroluminescent device and organic metal complex used for organic electroluminescent device	20190802
KR-20210016235-A	Organic electroluminescence device and organometallic complex for organic electroluminescence device	20190802
US-2021036243-A1	Organic electroluminescence device and organometallic complex for organic electroluminescence device	20190802
US-2021179588-A1	Unsymmetrical salts, ccc-nhc pincer metal complexes, and methods of making the same	20170321

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Related Functional Groups

Triazole/Tetrazole

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Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	222.97451
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	222.97451
Rotatable Bond Count:	1
Topological Polar Surface Area:	30.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.4