2-Amino-4,6-dibromophenol - CAS 10539-14-7

Catalog:	BB001635
Product Name:	2-Amino-4,6-dibromophenol
CAS:	10539-14-7
Synonyms:	2-amino-4,6-dibromophenol

Technical Data

Patents

Computed Properties

IUPAC Name:	2-amino-4,6-dibromophenol
Description:	2-Amino-4,6-dibromophenol (CAS# 10539-14-7) is a useful research chemical compound.
Molecular Weight:	266.92
Molecular Formula:	C6H5Br2NO
Canonical SMILES:	C1=C(C=C(C(=C1Br)O)N)Br
InChI:	InChI=1S/C6H5Br2NO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H,9H2
InChI Key:	UFWSOGOVXJBJDP-UHFFFAOYSA-N
Boiling Point:	287.8 °C at 760 mmHg
Density:	2.178 g/cm³
Appearance:	Solid
LogP:	3.08060

Publication Number	Title	Priority Date
CA-2951565-A1	Reactivity-based screening for natural product discovery	20140610
US-2017227545-A1	Reactivity-based screening for natural product discovery	20140610
WO-2015191789-A2	Reactivity-based screening for natural product discovery	20140610
US-2016145248-A1	Novel substituted bicyclic compounds as bromodomain inhibitors	20130621
US-2016184273-A1	Novel substituted bicyclic compounds as bromodomain inhibitors	20130621

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Complexity:	122
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	266.87174
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	264.87379
Rotatable Bond Count:	0
Topological Polar Surface Area:	46.2
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.3