3-Fluoro-5-morpholinoaniline - CAS 258864-18-5

Catalog:	BB019059
Product Name:	3-Fluoro-5-morpholinoaniline
CAS:	258864-18-5
Synonyms:	3-fluoro-5-(4-morpholinyl)aniline; 3-fluoro-5-morpholin-4-ylaniline

Technical Data

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Computed Properties

IUPAC Name:	3-fluoro-5-morpholin-4-ylaniline
Description:	3-Fluoro-5-morpholinoaniline (CAS# 258864-18-5) is a useful research chemical.
Molecular Weight:	196.22
Molecular Formula:	C10H13FN2O
Canonical SMILES:	C1COCCN1C2=CC(=CC(=C2)F)N
InChI:	InChI=1S/C10H13FN2O/c11-8-5-9(12)7-10(6-8)13-1-3-14-4-2-13/h5-7H,1-4,12H2
InChI Key:	DAZBEJAQBUHDRD-UHFFFAOYSA-N
MDL:	MFCD12763355
LogP:	1.89070

Publication Number	Title	Priority Date
KR-101705980-B1	Novel pazopanib derivatives and pharmaceutical composition comprising the same	20150612
KR-20160147170-A	Novel pazopanib derivatives and pharmaceutical composition comprising the same	20150612
US-10662193-B2	Carbazole and carboline compounds for use in the diagnosis, treatment, alleviation or prevention of disorders associated with amyloid or amyloid-like proteins	20140121
US-2017002005-A1	Carbazole and Carboline Compounds for Use in the Diagnosis, Treatment, Alleviation or Prevention of Disorders Associated with Amyloid or Amyloid-Like Proteins	20140121
WO-2015110263-A1	Carbazole and carboline compounds for use in the diagnosis, treatment, alleviation or prevention of disorders associated with amyloid or amyolid-like proteins	20140121

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	185
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	196.10119120
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	196.10119120
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.1