4-Amino-3-methylisoxazole - CAS 354795-62-3

Catalog:	BB022651
Product Name:	4-Amino-3-methylisoxazole
CAS:	354795-62-3
Synonyms:	3-methyl-4-isoxazolamine; 3-methyl-1,2-oxazol-4-amine

Technical Data

Patents

Computed Properties

IUPAC Name:	3-methyl-1,2-oxazol-4-amine
Description:	4-Amino-3-methylisoxazole (CAS# 354795-62-3) is a useful research chemical.
Molecular Weight:	98.10
Molecular Formula:	C4H6N2O
Canonical SMILES:	CC1=NOC=C1N
InChI:	InChI=1S/C4H6N2O/c1-3-4(5)2-7-6-3/h2H,5H2,1H3
InChI Key:	BNOWDJRGXLVJHD-UHFFFAOYSA-N
LogP:	1.14640

Publication Number	Title	Priority Date
WO-2020144638-A1	Dihydroorotate dehydrogenase inhibitors	20190111
KR-20210114968-A	dihydroorotate dehydrogenase inhibitor	20190111
WO-2020123395-A1	2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors	20181210
TW-202039487-A	2-oxoquinazoline derivatives as methionine adenosyltransferase 2a inhibitors	20181210
CN-113166078-A	2-oxoquinazoline derivatives as methionine adenosyltransferase 2A inhibitors	20181210

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Related Functional Groups

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[640291-92-5]
Ethyl 5-(4-fluorophenyl)isoxazole-3-carboxylate

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Complexity:	66.7
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	98.048012819
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	98.048012819
Rotatable Bond Count:	0
Topological Polar Surface Area:	52
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.1