Ethyl 4-Boc-2-morpholinecarboxylate - CAS 768371-16-0

Catalog:	BB035717
Product Name:	Ethyl 4-Boc-2-morpholinecarboxylate
CAS:	768371-16-0
Synonyms:	morpholine-2,4-dicarboxylic acid O4-tert-butyl ester O2-ethyl ester; 4-O-tert-butyl 2-O-ethyl morpholine-2,4-dicarboxylate

Technical Data

Patents

Computed Properties

IUPAC Name:	4-O-tert-butyl 2-O-ethyl morpholine-2,4-dicarboxylate
Description:	Ethyl 4-Boc-2-morpholinecarboxylate (CAS# 768371-16-0) is a useful research chemical.
Molecular Weight:	259.30
Molecular Formula:	C12H21NO5
Canonical SMILES:	CCOC(=O)C1CN(CCO1)C(=O)OC(C)(C)C
InChI:	InChI=1S/C12H21NO5/c1-5-16-10(14)9-8-13(6-7-17-9)11(15)18-12(2,3)4/h9H,5-8H2,1-4H3
InChI Key:	WOCMUJFSDGAHNY-UHFFFAOYSA-N
MDL:	MFCD01646390
LogP:	1.12330

Publication Number	Title	Priority Date
US-2021078996-A1	Hpk1 antagonists and uses thereof	20190913
US-2021078997-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROL[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913
US-2021078998-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913
US-2021087189-A1	SUBSTITUTED ISINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,3-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913
US-2021087190-A1	SUBSTITUTED ISOINDOLIN-1-ONES AND 2,3-DIHYDRO-1H-PYRROLO[3,4-c]PYRIDIN-1-ONES AS HPK1 ANTAGONISTS	20190913

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Complexity:	310
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	259.14197277
Formal Charge:	0
Heavy Atom Count:	18
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	259.14197277
Rotatable Bond Count:	5
Topological Polar Surface Area:	65.1
Undefined Atom Stereocenter Count:	1
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1