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5-Bromo-2,3-dihydro-1H-inden-1-one Oxime

5-Bromo-2,3-dihydro-1H-inden-1-one Oxime - CAS 185122-63-8

Catalog:	BB014195
Product Name:	5-Bromo-2,3-dihydro-1H-inden-1-one Oxime
CAS:	185122-63-8
Synonyms:	5-bromo-2,3-dihydroinden-1-one oxime; N-(5-bromo-2,3-dihydroinden-1-ylidene)hydroxylamine

Technical Data

Patents

Computed Properties

IUPAC Name:	(NZ)-N-(5-bromo-2,3-dihydroinden-1-ylidene)hydroxylamine
Description:	5-Bromo-2,3-dihydro-1H-inden-1-one Oxime (CAS# 185122-63-8 ) is a useful research chemical.
Molecular Weight:	226.07
Molecular Formula:	C9H8BrNO
Canonical SMILES:	C1CC(=NO)C2=C1C=C(C=C2)Br
InChI:	InChI=1S/C9H8BrNO/c10-7-2-3-8-6(5-7)1-4-9(8)11-12/h2-3,5,12H,1,4H2
InChI Key:	FKVWLYRRDKFLBM-UHFFFAOYSA-N
LogP:	2.57360

Publication Number	Title	Priority Date
US-2018002346-A1	Azolobenzazine compounds, compositions comprising these compounds and their use for controlling invertebrate pests	20150114
US-2017137385-A1	Isoquinoline compounds, a process for their preparation, and pharmaceutical compositions containing them	20140221
US-9809553-B2	Isoquinoline compounds, a process for their preparation, and pharmaceutical compositions containing them	20140221
US-2016157491-A1	Pesticide Compounds	20130715
US-9497970-B2	Pesticide compounds	20130715

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Complexity:	205
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	224.97893
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	224.97893
Rotatable Bond Count:	0
Topological Polar Surface Area:	32.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6