5-Bromo-4-pyrimidinemethanol - CAS 811450-15-4

Catalog:	BB036613
Product Name:	5-Bromo-4-pyrimidinemethanol
CAS:	811450-15-4
Synonyms:	(5-bromo-4-pyrimidinyl)methanol; (5-bromopyrimidin-4-yl)methanol

Technical Data

Patents

Computed Properties

IUPAC Name:	(5-bromopyrimidin-4-yl)methanol
Description:	5-Bromo-4-pyrimidinemethanol (CAS# 811450-15-4 ) is a useful research chemical.
Molecular Weight:	189.01
Molecular Formula:	C5H5BrN2O
Canonical SMILES:	C1=C(C(=NC=N1)CO)Br
InChI:	InChI=1S/C5H5BrN2O/c6-4-1-7-3-8-5(4)2-9/h1,3,9H,2H2
InChI Key:	UTNGUJARERCBBD-UHFFFAOYSA-N
Boiling Point:	315.972 °C at 760 mmHg
Density:	1.785 g/cm³
LogP:	0.73140

Publication Number	Title	Priority Date
AU-2014274644-A1	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223
AU-2014274644-B2	New thienopyrimidine derivatives, a process for their preparation and pharmaceutical compositions containing them	20131223
CA-2875226-A1	Thienopyrimidine derivatives, process for their preparation, pharmaceutical compositions containing them and their use in the treatment of conditions involving a defect in apoptosis	20131223
CA-2875226-C	Thienopyrimidine derivatives, process for their preparation, pharmaceutical compositions containing them and their use in the treatment of conditions involving a defect in apoptosis	20131223
DK-2886545-T3	Thienopyrimidinderivater new, a process for their preparation and pharmaceutical compositions containing them	20131223

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Complexity:	91
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	187.95853
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	187.95853
Rotatable Bond Count:	1
Topological Polar Surface Area:	46
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0