4-(2-Fluoro-4-isocyanatophenyl)morpholine - CAS 224323-51-7

Catalog:	BB017608
Product Name:	4-(2-Fluoro-4-isocyanatophenyl)morpholine
CAS:	224323-51-7
Synonyms:	4-(2-fluoro-4-isocyanatophenyl)morpholine; 4-(2-fluoro-4-isocyanatophenyl)morpholine

Technical Data

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Computed Properties

IUPAC Name:	4-(2-fluoro-4-isocyanatophenyl)morpholine
Description:	4-(2-Fluoro-4-isocyanatophenyl)morpholine (CAS# 224323-51-7) is a useful research chemical.
Molecular Weight:	222.22
Molecular Formula:	C11H11FN2O2
Canonical SMILES:	C1COCCN1C2=C(C=C(C=C2)N=C=O)F
InChI:	InChI=1S/C11H11FN2O2/c12-10-7-9(13-8-15)1-2-11(10)14-3-5-16-6-4-14/h1-2,7H,3-6H2
InChI Key:	JFYQLZHULWIALT-UHFFFAOYSA-N
LogP:	1.78270

Publication Number	Title	Priority Date
US-2016102064-A1	Improved processes for the preparation of linezolid using novel intermediates	20130425
US-9586913-B2	Processes for the preparation of linezolid using novel intermediates	20130425
WO-2014174522-A1	Improved processes for the preparation of linezolid using novel intermediates	20130425
WO-2014045292-A1	Improved process for the preparation of linezolid intermediate	20120920
CN-102702125-A	Chemical synthesis method for linezolid	20120510

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Complexity:	275
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	222.08045576
Formal Charge:	0
Heavy Atom Count:	16
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	222.08045576
Rotatable Bond Count:	2
Topological Polar Surface Area:	41.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	2.6