AG00ECK0

64837-53-2 | 5-Amino-1,3,4-thiadiazole-2-carboxylic acid ethyl ester

AG00ECK0

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CAS Number	64837-53-2
Catalog Number	AG00ECK0(AGN-PC-0KKL57)
Chemical Name	5-Amino-1,3,4-thiadiazole-2-carboxylic acid ethyl ester
IUPAC Name	ethyl 5-amino-1,3,4-thiadiazole-2-carboxylate
InChI	InChI=1S/C5H7N3O2S/c1-2-10-4(9)3-7-8-5(6)11-3/h2H2,1H3,(H2,6,8)
InChI Key	YVKRWIVXIPGKTL-UHFFFAOYSA-N
MDL Number	MFCD03093787
Molecular Formula	C5H7N3O2S
Molecular Weight	173.1930
SMILES	O=C(C1=NN=C(N)S1)OCC
Synonyms	ethyl 5-amino-1,3,4-thiadiazole-2-carboxylate, 64837-53-2, 5-Amino-1,3,4-thiadiazole-2-carboxylic acid ethyl ester, 1,3,4-Thiadiazole-2-carboxylic acid, 5-amino-, ethyl ester, 1,3,4-Thiadiazole-2-carboxylicacid, 5-amino-, ethyl ester, 5-amino-[1,3,4]thiadiazole-2-carboxylic acid ethyl ester, AC1MBTUI, SCHEMBL283280, CTK5C1764, DTXSID80373421, YVKRWIVXIPGKTL-UHFFFAOYSA-N, ACN-C001111, KS-000025YK, ZINC2506721, ANW-47083, BBL102566, MFCD03093787, SBB059527, STL556369, AKOS001798166, AB13260, CS-W004849, GS-3833, MCULE-1652845956, RP23553, AC-28058, AJ-36142, AK-48431, BR-48431, CJ-08494, SC-43529, AB0026045, TC-068043, FT-0713247, ST24033202, ST51041518, W7628, S-2652, ethyl 5-azanyl-1,3,4-thiadiazole-2-carboxylate, A834894, ethyl (5-amino-1,3,4-thiadiazole-2-carboxylate), Z1416200876, C5H7N3O2S, ZINC02506721, CID2756556, 5-AMINO-1,3,4-THIADIAZOLE-2-CARBOXYLICACIDETHYLESTER, Ethyl 5-amino-1,3,4-thiadiazole-2-carboxylate, 97% - 1G 1g,

Complexity	155
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	173.026g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	173.19g/mol
Monoisotopic Mass	173.026g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	106A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.6

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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