2-(4,6-Dichloro-5-pyrimidyl)ethanol - CAS 853680-74-7

Catalog:	BB037600
Product Name:	2-(4,6-Dichloro-5-pyrimidyl)ethanol
CAS:	853680-74-7
Synonyms:	2-(4,6-dichloro-5-pyrimidinyl)ethanol; 2-(4,6-dichloropyrimidin-5-yl)ethanol

Technical Data

Patents

Computed Properties

IUPAC Name:	2-(4,6-dichloropyrimidin-5-yl)ethanol
Description:	2-(4,6-Dichloro-5-pyrimidyl)ethanol (CAS# 853680-74-7) is a useful research chemical.
Molecular Weight:	193.03
Molecular Formula:	C6H6Cl2N2O
Canonical SMILES:	C1=NC(=C(C(=N1)Cl)CCO)Cl
InChI:	InChI=1S/C6H6Cl2N2O/c7-5-4(1-2-11)6(8)10-3-9-5/h3,11H,1-2H2
InChI Key:	OTBRMFUGQGCCMO-UHFFFAOYSA-N
LogP:	1.31820

Publication Number	Title	Priority Date
WO-2021123798-A1	1h-pyrazolo[3,4-d]pyrimidine compounds useful for the treatment of platinum-resistant cancer	20191219
CN-110563655-A	Preparation method of 5- (2-bromoethyl) pyrimidine	20190924
EP-3197898-A1	Novel imidazopyridazine compounds and their use	20140924
EP-3197898-B1	Novel imidazopyridazine compounds and their use	20140924
KR-102006670-B1	Novel Imidazopyridazine Compounds and their Use	20140924

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Complexity:	115
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	191.9857182
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	191.9857182
Rotatable Bond Count:	2
Topological Polar Surface Area:	46
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.7