1-Bromo-2-nitronaphthalene - CAS 4185-55-1

Catalog:	BB024977
Product Name:	1-Bromo-2-nitronaphthalene
CAS:	4185-55-1
Synonyms:	1-bromo-2-nitronaphthalene; 1-bromo-2-nitronaphthalene

Technical Data

Patents

Computed Properties

IUPAC Name:	1-bromo-2-nitronaphthalene
Description:	1-Bromo-2-nitronaphthalene (CAS# 4185-55-1) is a useful research chemical compound.
Molecular Weight:	252.06
Molecular Formula:	C10H6BrNO2
Canonical SMILES:	C1=CC=C2C(=C1)C=CC(=C2Br)[N+](=O)[O-]
InChI:	InChI=1S/C10H6BrNO2/c11-10-8-4-2-1-3-7(8)5-6-9(10)12(13)14/h1-6H
InChI Key:	LEHBLKHJWCNXKQ-UHFFFAOYSA-N
LogP:	4.03370

Publication Number	Title	Priority Date
KR-20210097470-A	Compound for organic electronic element, organic electronic element using the same, and an electronic device thereof	20200130
CN-111072677-A	Organic compound and application thereof	20191227
KR-20210081966-A	Organic compounds and organic electro luminescence device comprising the same	20191224
WO-2021114313-A1	Ion channel antagonists/blockers and uses thereof	20191214
CN-112940016-A	Transition metal complexes, mixtures, compositions and organic electronic devices	20191211

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Complexity:	229
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	250.95819
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	250.95819
Rotatable Bond Count:	0
Topological Polar Surface Area:	45.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.7