(S)-3-Methylmorpholine - CAS 350595-57-2

Catalog:	BB022405
Product Name:	(S)-3-Methylmorpholine
CAS:	350595-57-2
Synonyms:	(3S)-3-methylmorpholine; (3S)-3-methylmorpholine

Technical Data

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Computed Properties

IUPAC Name:	(3S)-3-methylmorpholine
Description:	(S)-3-Methylmorpholine (CAS# 350595-57-2) is useful in preparation of morpholinopyrimidine derivatives as mTOR kinase inhibitors for the treatment of diseases mediated by mTOR kinase and/or one or more PI3K enzymes.
Molecular Weight:	101.15
Molecular Formula:	C5H11NO
Canonical SMILES:	CC1COCCN1
InChI:	InChI=1S/C5H11NO/c1-5-4-7-3-2-6-5/h5-6H,2-4H2,1H3/t5-/m0/s1
InChI Key:	SFWWGMKXCYLZEG-YFKPBYRVSA-N
Boiling Point:	137.1 °C at 760 mmHg
Density:	0.891 g/cm³
MDL:	MFCD03840369
LogP:	0.32350

Publication Number	Title	Priority Date
CN-112209900-A	Method for preparing 4-cyclohexylmorpholine compound by using lignin model compound	20200923
WO-2021210586-A1	Condensed heterocyclic compound	20200414
CN-111153891-A	Substituted benzimidazole PI3K Î±/mTOR double-target inhibitor and pharmaceutical composition and application thereof	20200110
CN-113072476-A	ROR gamma t inhibitor and preparation method and application thereof	20200106
WO-2021139599-A1	RORÎ³T INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF	20200106

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Related Functional Groups

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[1185683-82-2]
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[2006277-82-1]
4-(5-Bromopentyl)morpholine Hydrobromide

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GHS Hazard Statement:	H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501
Signal Word:	Danger

Complexity:	56
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	101.084063974
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	101.084063974
Rotatable Bond Count:	0
Topological Polar Surface Area:	21.3 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.1