5-(Methylsulfonyl)pyrimidine - CAS 14080-16-1

Catalog:	BB009112
Product Name:	5-(Methylsulfonyl)pyrimidine
CAS:	14080-16-1
Synonyms:	5-methylsulfonylpyrimidine; 5-methylsulfonylpyrimidine

Technical Data

Patents

Computed Properties

IUPAC Name:	5-methylsulfonylpyrimidine
Description:	5-(Methylsulfonyl)pyrimidine (CAS# 14080-16-1 ) is a useful research chemical.
Molecular Weight:	158.18
Molecular Formula:	C5H6N2O2S
Canonical SMILES:	CS(=O)(=O)C1=CN=CN=C1
InChI:	InChI=1S/C5H6N2O2S/c1-10(8,9)5-2-6-4-7-3-5/h2-4H,1H3
InChI Key:	FKACIIOBLKNRPT-UHFFFAOYSA-N
LogP:	0.96090

Publication Number	Title	Priority Date
BR-112020020832-A2	BCL6 INHIBITORS	20180413
CN-107635974-A	2 (phenoxy group or thiophenyl) pyrimidine derivatives as herbicide	20150605
CN-107250134-A	It is used as the substituted 2-pyrimidinyl oxy pyridine derivate of herbicide	20150318
AU-2015280138-B2	Phosphatidylinositol 3-kinase inhibitors	20140624
US-2014274951-A1	Ligand-therapeutic agent conjugates, silicon-based linkers, and methods for making and using them	20130314

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Related Functional Groups

Sulfur Compounds

[85-47-2]
1-Naphthalenesulfonic acid
[162894-76-0]
2-Hydroxyethane-1-sulfonamide
[42729-26-0]
3-(Trifluoromethylthio)phenyl isothiocyanate
[15863-41-9]
4-(Methylthio)phenyl isothiocyanate
[5310-68-9]
4-Chlorophenylsulphur pentafluoride
[1005651-99-9]
5-[(5-Methyl-1H-pyrazol-1-yl)methyl]-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazole-3-thiol

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Complexity:	188
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.01499861
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	158.01499861
Rotatable Bond Count:	1
Topological Polar Surface Area:	68.3
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.6