2-Chloro-5-(trifluoromethoxy)benzimidazole - CAS 886465-16-3

Catalog:	BB039090
Product Name:	2-Chloro-5-(trifluoromethoxy)benzimidazole
CAS:	886465-16-3
Synonyms:	2-chloro-6-(trifluoromethoxy)-1H-benzimidazole; 2-chloro-6-(trifluoromethoxy)-1H-benzimidazole

Technical Data

Patents

Computed Properties

IUPAC Name:	2-chloro-6-(trifluoromethoxy)-1H-benzimidazole
Description:	2-Chloro-5-(trifluoromethoxy)benzimidazole (CAS# 886465-16-3 ) is a useful research chemical.
Molecular Weight:	236.58
Molecular Formula:	C8H4ClF3N2O
Canonical SMILES:	C1=CC2=C(C=C1OC(F)(F)F)NC(=N2)Cl
InChI:	InChI=1S/C8H4ClF3N2O/c9-7-13-5-2-1-4(3-6(5)14-7)15-8(10,11)12/h1-3H,(H,13,14)
InChI Key:	DZCNHAOGTIIZDP-UHFFFAOYSA-N
LogP:	3.11490

Publication Number	Title	Priority Date
EP-3519412-A1	Cyanopyrrolidine derivatives with activity as inhibitors of usp30	20160930
JP-2019532950-A	Cyanopyrrolidine derivatives having activity as inhibitors of USP30	20160930
US-2020199126-A1	Cyanopyrrolidine derivatives with activity as inhibitors of usp30	20160930
WO-2018060742-A1	Cyanopyrrolidine derivatives with activity as inhibitors of usp30	20160930
US-11084821-B2	Cyanopyrrolidine derivatives with activity as inhibitors of USP30	20160930

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Complexity:	238
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	235.9964249
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	235.9964249
Rotatable Bond Count:	1
Topological Polar Surface Area:	37.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.1