Tetrahydropyran-4-ylmethyl methanesulfonate - CAS 132291-95-3

Catalog:	BB007571
Product Name:	Tetrahydropyran-4-ylmethyl methanesulfonate
CAS:	132291-95-3
Synonyms:	oxan-4-ylmethyl methanesulfonate

Technical Data

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Computed Properties

IUPAC Name:	oxan-4-ylmethyl methanesulfonate
Description:	Tetrahydropyran-4-ylmethyl methanesulfonate (CAS# 132291-95-3) is a useful research chemical.
Molecular Weight:	194.25
Molecular Formula:	C7H14O4S
Canonical SMILES:	CS(=O)(=O)OCC1CCOCC1
InChI:	InChI=1S/C7H14O4S/c1-12(8,9)11-6-7-2-4-10-5-3-7/h7H,2-6H2,1H3
InChI Key:	HJZXNSXKMBRTJZ-UHFFFAOYSA-N
Purity:	95 %
Storage:	Sealed in dry, 2-8 ℃
LogP:	1.47000

Publication Number	Title	Priority Date
WO-2020003093-A1	Pyridin-3-yl acetic acid derivatives as inhibitors of human immunodeficiency virus replication	20180625
WO-2019191599-A1	Bicyclic enone carboxylates as modulators of transporters and uses thereof	20180330
US-2021053982-A1	Bicyclic enone carboxylates as modulators of transporters and uses thereof	20180330
WO-2019191112-A1	Cereblon binders for the degradation of ikaros	20180326
CN-111902141-A	Glucocerebroside binders for IKAROS degradation	20180326

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Complexity:	210
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	194.0612801
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	194.0612801
Rotatable Bond Count:	3
Topological Polar Surface Area:	61
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2