2-Amino-4-chlorobiphenyl - CAS 90-48-2

Catalog:	BB039866
Product Name:	2-Amino-4-chlorobiphenyl
CAS:	90-48-2
Synonyms:	5-chloro-2-phenylaniline; 5-chloro-2-phenylaniline

Technical Data

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Computed Properties

IUPAC Name:	5-chloro-2-phenylaniline
Description:	2-Amino-4-chlorobiphenyl (CAS# 90-48-2) is a useful research chemical compound.
Molecular Weight:	203.67
Molecular Formula:	C12H10ClN
Canonical SMILES:	C1=CC=C(C=C1)C2=C(C=C(C=C2)Cl)N
InChI:	InChI=1S/C12H10ClN/c13-10-6-7-11(12(14)8-10)9-4-2-1-3-5-9/h1-8H,14H2
InChI Key:	IBGNKLJXZBMJTN-UHFFFAOYSA-N
LogP:	4.17040

Publication Number	Title	Priority Date
CN-213853210-U	4-chlorine-2-aminobiphenyl extraction device	20201106
US-2019161485-A1	Organic compound, organic light emitting diode including the same and display including the organic light emitting diode	20171130
US-2020031772-A1	Process for preparation of boscalid anhydrate form i and boscalid anhydrate form ii	20160928
US-10934259-B2	Process for preparation of boscalid anhydrate form I and boscalid anhydrate form II	20160928
EP-3024836-A1	Improved process for preparing chlorinated biphenylanilides and biphenylanilines	20130723

PMID	Publication Date	Title	Journal
21851087	20111013	Dihydroquinazolines as a novel class of Trypanosoma brucei trypanothione reductase inhibitors: discovery, synthesis, and characterization of their binding mode by protein crystallography	Journal of medicinal chemistry
19296695	20090326	Development of a novel virtual screening cascade protocol to identify potential trypanothione reductase inhibitors	Journal of medicinal chemistry
21901070	20070101	Trypanothione reductase: a viable chemotherapeutic target for antitrypanosomal and antileishmanial drug design	Drug target insights
16335933	20051215	Antitrypanosomal, antileishmanial, and antimalarial activities of quaternary arylalkylammonium 2-amino-4-chlorophenyl phenyl sulfides, a new class of trypanothione reductase inhibitor, and of N-acyl derivatives of 2-amino-4-chlorophenyl phenyl sulfide	Journal of medicinal chemistry

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Complexity:	177
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	203.050177
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	203.050177
Rotatable Bond Count:	1
Topological Polar Surface Area:	26
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4