2-Morpholinoaniline - CAS 5585-33-1

Catalog:	BB029199
Product Name:	2-Morpholinoaniline
CAS:	5585-33-1
Synonyms:	2-morpholin-4-ylaniline

Technical Data

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Computed Properties

IUPAC Name:	2-morpholin-4-ylaniline
Description:	2-Morpholinoaniline (CAS# 5585-33-1) is a useful research chemical.
Molecular Weight:	178.23
Molecular Formula:	C10H14N2O
Canonical SMILES:	C1COCCN1C2=CC=CC=C2N
InChI:	InChI=1S/C10H14N2O/c11-9-3-1-2-4-10(9)12-5-7-13-8-6-12/h1-4H,5-8,11H2
InChI Key:	QKWLVAYDAHQMLG-UHFFFAOYSA-N
Boiling Point:	332.5 °C at 760 mmHg
Density:	1.149 g/cm³
MDL:	MFCD00047408
LogP:	1.75160

Publication Number	Title	Priority Date
WO-2021119081-A1	Hepatitis b capsid assembly modulators	20191210
WO-2021110306-A1	Multi-tone hair dyeing method in three steps	20191203
EP-3821947-A1	Heterocyclic trpml1 agonists	20191113
WO-2021094974-A1	Heterocyclic trpml1 agonists	20191113
WO-2021041866-A1	Small molecule agonists of mucolipin 1 and uses thereof	20190830

PMID	Publication Date	Title	Journal
20502549	20090701	Synthesis and pharmacological evaluation of schiff bases of 4-(2-aminophenyl)-morpholines	Indian journal of pharmaceutical sciences

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Related Functional Groups

Amines and Anilines

[1158353-54-8]
(4-Pyrazol-1-ylphenyl)methanamine sulfuric acid
[1006473-17-1]
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[1106917-71-8]
[3-(Difluoromethoxy)phenyl]methanamine hydrochloride
[1225940-17-9]
1-(3-Chloro-4-methylphenyl)-3-(trifluoromethyl)pyrazole-5-ylamine
[932890-93-2]
1-{4-[(2,4-Dichlorobenzyl)oxy]-3-ethoxyphenyl}methanamine
[1951441-75-0]
2-(6-Methoxypyridin-2-yl)ethan-1-amine hydrochloride

Morpholines/Thiomorpholines

[1431966-58-3]
2,2-Difluoro-N-(2-morpholin-4-ylethyl)ethanamine dihydrochloride
[4441-30-9]
4-(3-Hydroxypropyl)morpholine
[1005586-29-7]
Ethyl 1-methyl-3-(morpholin-4-ylcarbonyl)pyrazole-5-carboxylate
[152009-44-4]
Ethyl Thiomorpholine-2-carboxylate
[267243-68-5]
Intermediate 2 of Canertinib
[690634-79-8]
Morpholino(2-piperidinyl)methanone Hydrochloride

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:	157
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	178.110613074
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	178.110613074
Rotatable Bond Count:	1
Topological Polar Surface Area:	38.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1