4-Amino-2-bromopyrimidine - CAS 1160994-71-7

Catalog:	BB003711
Product Name:	4-Amino-2-bromopyrimidine
CAS:	1160994-71-7
Synonyms:	2-bromo-4-pyrimidinamine; 2-bromopyrimidin-4-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	2-bromopyrimidin-4-amine
Description:	4-Amino-2-bromopyrimidine (CAS# 1160994-71-7) is a useful research chemical.
Molecular Weight:	174.01
Molecular Formula:	C4H4BrN3
Canonical SMILES:	C1=CN=C(N=C1N)Br
InChI:	InChI=1S/C4H4BrN3/c5-4-7-2-1-3(6)8-4/h1-2H,(H2,6,7,8)
InChI Key:	QILIOIATCPZRJQ-UHFFFAOYSA-N
Storage:	Keep in dark place, Inert atmosphere, 2-8 °C
MDL:	MFCD11109798
LogP:	1.40250

Publication Number	Title	Priority Date
CN-110372706-A	A kind of synthetic method of anti-tumor drug Rui Boxini intermediate	20190820
EP-3194394-A1	Pesticidally active tetracyclic derivatives with sulphur containing substituents	20140916
WO-2016041819-A1	Pesticidally active tetracyclic derivatives with sulphur containing substituents	20140916
US-2015263290-A1	Condensed cyclic compound and organic light-emitting device including the same	20140311
EP-3052494-A1	Azaindazole compounds as inhibitors of t790m containing egfr mutants	20130628

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Complexity:	77.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	172.95886
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	172.95886
Rotatable Bond Count:	0
Topological Polar Surface Area:	51.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9