AG008TRL

108511-97-3 | 4-Aminoisoxazole

AG008TRL

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CAS Number	108511-97-3
Catalog Number	AG008TRL(AGN-PC-00O279)
Chemical Name	4-Aminoisoxazole
IUPAC Name	1,2-oxazol-4-amine
InChI	InChI=1S/C3H4N2O/c4-3-1-5-6-2-3/h1-2H,4H2
InChI Key	CVCYZCBJCQXUCN-UHFFFAOYSA-N
MDL Number	MFCD08234629
Molecular Formula	C3H4N2O
Molecular Weight	84.0767
SMILES	NC1=CON=C1
Synonyms	4-Aminoisoxazole, Isoxazol-4-amine, 108511-97-3, 1,2-oxazol-4-amine, 4-ISOXAZOLAMINE, ISOXAZOL-4-YLAMINE, Isoxazole-4-amine, PubChem22316, AC1Q52IR, ACMC-1C5Q2, 4-Aminoisoxazole, AldrichCPR, CTK0H0502, DTXSID30549977, CVCYZCBJCQXUCN-UHFFFAOYSA-N, ALBB-032264, ANW-51241, CA-076, MFCD08234629, ZINC26510219, AKOS007930457, AB43605, MCULE-7932471087, RTR-001967, AJ-82520, AK-24626, BR-24626, CJ-17492, SC-94194, AB0034690, DB-003455, DB-012775, ST2419440, TR-001967, FT-0649457, X8883, EN300-44060, J3.534.619H, S-5946, A801888, J-002158, I14-32919, I14-41276, C3H4N2O, 4-Aminoisoxazole Dihydrochloride, ACN-027331, 108511-98-4,

Complexity	48.1
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	84.032g/mol
Formal Charge	0
Heavy Atom Count	6
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	84.078g/mol
Monoisotopic Mass	84.032g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	52A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H315-H319-H335
Packing Group	\N
Precautionary statements	P261-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number