AG007GSQ

32326-25-3 | 5-Methoxyisoxazol-3-amine

AG007GSQ

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CAS Number	32326-25-3
Catalog Number	AG007GSQ(AGN-PC-0NECFE)
Chemical Name	5-Methoxyisoxazol-3-amine
EC Number	608-729-1
IUPAC Name	5-methoxy-1,2-oxazol-3-amine
InChI	InChI=1S/C4H6N2O2/c1-7-4-2-3(5)6-8-4/h2H,1H3,(H2,5,6)
InChI Key	PVDLBNRYTGXVPC-UHFFFAOYSA-N
MDL Number	MFCD09701967
Molecular Formula	C4H6N2O2
Molecular Weight	114.1026
SMILES	COC1=CC(=NO1)N
Synonyms	5-Methoxyisoxazol-3-amine, 32326-25-3, 3-Amino-5-methoxyisoxazole, 5-methoxy-1,2-oxazol-3-amine, 3-Amine-5-methoxyisoxazole, 3-Isoxazolamine, 5-methoxy-, AK-25770, ACMC-1AE2L, 5-methoxy-3-isoxazolamine, 3-Isoxazolamine,5-methoxy-, SCHEMBL1687200, Jsp005977, CTK4G8522, KS-00000KIP, DTXSID60451554, CS-D0691, ANW-27328, FCH869128, MFCD09701967, ZINC21298963, AKOS006330904, AC-5606, GS-3317, RP19128, TRA0029868, AJ-78233, AN-10801, BR-25770, CJ-16853, SY006835, AB0017988, AB1006493, AX8033208, ST2412077, TC-116073, TL8002456, 4CH-013452, AM20090468, FT-0648178, EN300-216169, S-4056, MFCD09701967 (97+%), 326M253, A821236, J-517704, 5-Methoxyisoxazol-3-amine; 3-Amine-5-methoxyisoxazole, I14-17746, o-Toluenesulfonyl isocyanate, C4H6N2O2, CID11007859, R093,

Complexity	78.4
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	114.043g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	114.104g/mol
Monoisotopic Mass	114.043g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	61.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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