AG001J13

144167-51-1 | 1,2,4-Oxadiazole-3-carboxylic acid, 5-amino-, ethyl ester

AG001J13

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CAS Number	144167-51-1
Catalog Number	AG001J13(AGN-PC-0CUMVW)
Chemical Name	1,2,4-Oxadiazole-3-carboxylic acid, 5-amino-, ethyl ester
IUPAC Name	ethyl 5-amino-1,2,4-oxadiazole-3-carboxylate
InChI	InChI=1S/C5H7N3O3/c1-2-10-4(9)3-7-5(6)11-8-3/h2H2,1H3,(H2,6,7,8)
InChI Key	ZRDSRXFGWKCXDJ-UHFFFAOYSA-N
MDL Number	MFCD16990591
Molecular Formula	C5H7N3O3
Molecular Weight	157.1274
SMILES	NC1=NC(=NO1)C(=O)OCC
Synonyms	144167-51-1, ETHYL 5-AMINO-1,2,4-OXADIAZOLE-3-CARBOXYLATE, 1,2,4-Oxadiazole-3-carboxylic acid, 5-amino-, ethyl ester, SCHEMBL7916192, 5-Amino-[1,2,4]oxadiazole-3-carboxylic acid ethyl ester, ALBB-027954, 4093AJ, MFCD16990591, ZINC95762061, AKOS022185939, AB71593, CS-W000689, 5-amino-3-carbethoxy-1,2,4-oxadiazole, AS-48417, SY248521, AJ-133817, FT-0697682, MFCD16990591 (95%), 5-Amino-1,2,4oxadiazole-3-carboxylic acid ethyl ester, C5H7N3O3,

Complexity	152
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	157.049g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	157.129g/mol
Monoisotopic Mass	157.049g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	91.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H314
Precuationary statements	P280-P305+P351+P338-P310
Siginal words

Certificate of Analysis

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