AG00DHUQ

55904-84-2 | 3,4-Diethoxy-1,2,5-thiadiazole-1,1-dioxide

AG00DHUQ

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CAS Number	55904-84-2
Catalog Number	AG00DHUQ(AGN-PC-004LFV)
Chemical Name	3,4-Diethoxy-1,2,5-thiadiazole-1,1-dioxide
IUPAC Name	3,4-diethoxy-1,2,5-thiadiazole 1,1-dioxide
InChI	InChI=1S/C6H10N2O4S/c1-3-11-5-6(12-4-2)8-13(9,10)7-5/h3-4H2,1-2H3
InChI Key	WZMXSPCYRSRMJT-UHFFFAOYSA-N
MDL Number	MFCD18432413
Molecular Formula	C6H10N2O4S
Molecular Weight	206.2196
SMILES	C(C)OC1=N[S](N=C1OCC)(=O)=O
Synonyms	3,4-DIETHOXY-1,2,5-THIADIAZOLE-1,1-DIOXIDE, 55904-84-2, 3,4-diethoxy-1,2,5-thiadiazole 1,1-dioxide, 1,2,5-Thiadiazole, 3,4-diethoxy-, 1,1-dioxide, AK-43495, SCHEMBL2058933, CTK1F5663, DTXSID30459067, WZMXSPCYRSRMJT-UHFFFAOYSA-N, KS-00000OK5, ANW-49438, MFCD18432413, ZINC34408809, AKOS015920002, CS-W019056, VZ25500, AJ-88355, BR-43495, CJ-18347, DS-14180, SC-93717, diethoxy-1??,2,5-thiadiazole-1,1-dione, DB-072066, TC-138183, 4CH-010250, FT-0746434, ST24028182, W6979, 3,4-diethyloxy-1,1-dioxo-1,2,5-thiadiazole, diethoxy-1$l^{6},2,5-thiadiazole-1,1-dione, S-5915, 3,4-Diethoxy-[1,2,5]thiadiazole-1,1-dioxide, C6H10N2O4S, CID11217995,

Complexity	310
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	206.036g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	206.216g/mol
Monoisotopic Mass	206.036g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	85.7A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
Signal Words	warning
UN Code

Certificate of Analysis

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