5-(Benzyloxy)-2-bromopyridine - CAS 630120-99-9

Catalog:	BB031945
Product Name:	5-(Benzyloxy)-2-bromopyridine
CAS:	630120-99-9
Synonyms:	2-bromo-5-phenylmethoxypyridine; 2-bromo-5-phenylmethoxypyridine

Technical Data

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Computed Properties

IUPAC Name:	2-bromo-5-phenylmethoxypyridine
Description:	5-(Benzyloxy)-2-bromopyridine (CAS# 630120-99-9) is a useful research chemical.
Molecular Weight:	264.12
Molecular Formula:	C12H10BrNO
Canonical SMILES:	C1=CC=C(C=C1)COC2=CN=C(C=C2)Br
InChI:	InChI=1S/C12H10BrNO/c13-12-7-6-11(8-14-12)15-9-10-4-2-1-3-5-10/h1-8H,9H2
InChI Key:	KKCMCYRLJVVNTQ-UHFFFAOYSA-N
LogP:	3.42310

Publication Number	Title	Priority Date
WO-2020186220-A1	Compounds as inhibitors of macrophage migration inhibitory factor	20190313
WO-2020162612-A1	Pyridine compound substituted by heteroaryl	20190208
JP-2020128368-A	Medicine containing an azole-substituted pyridine compound as an active ingredient	20190208
TW-202045494-A	Pyridine compounds substituted by heteroaryl	20190208
US-2020164024-A1	Cyclic tetramer compounds as proprotein convertase subtilisin/kexin type 9 (pcsk9) inhibitors for the treatment of metabolic disorders	20181127

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Complexity:	183
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	262.99458
Formal Charge:	0
Heavy Atom Count:	15
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	262.99458
Rotatable Bond Count:	3
Topological Polar Surface Area:	22.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.3