AG00I7PX

39093-93-1 | Thiomorpholine, 1,1-dioxide

AG00I7PX

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CAS Number	39093-93-1
Catalog Number	AG00I7PX(AGN-PC-0LU5CZ)
Chemical Name	Thiomorpholine, 1,1-dioxide
IUPAC Name	1,4-thiazinane 1,1-dioxide
InChI	InChI=1S/C4H9NO2S/c6-8(7)3-1-5-2-4-8/h5H,1-4H2
InChI Key	NDOVLWQBFFJETK-UHFFFAOYSA-N
MDL Number	MFCD05861623
Molecular Formula	C4H9NO2S
Molecular Weight	135.1848
SMILES	O=S1(CCNCC1)=O
Synonyms	Thiomorpholine 1,1-dioxide, 39093-93-1, Thiomorpholine-1,1-dioxide, Thiomorpholine dioxide, Thiomorpholine, 1,1-dioxide, 1,1-Dioxothiomorpholine, 1,4-thiazinane 1,1-dioxide, 1,1-DIOXIDOTHIOMORPHOLINE, Thiomorpholine1,1-dioxide, 1,1-Dioxide-4-thiomorpholine, AK-34978, tetrahydro-2H-1,4-thiazine 1,1-dioxide, EN300-43009, 1,4-thiazaperhydroine-1,1-dione, 1,1-DIOXOTHIOMORPHOLINE HYDROCHLORIDE, PubChem10419, BAS 10153811, 1,1-dioxo-thiomorpholin, AC1O5HDY, 1,1-Dioxo-thiomorpholine, thiomopholine 1,1-dioxide, thiomorpholin 1,1-dioxide, thiomorpholin-1,1-dioxide, thiomorpholine S,S-dioxide, thiomorpholine-S,S-dioxide, 1,1-dioxo-thio-morpholine, thiomorpholine 1,1 dioxide, AC1Q6YU1, ACMC-1AH55, SCHEMBL13422, CHEMBL2448869, CTK1C2180, DTXSID80424427, NDOVLWQBFFJETK-UHFFFAOYSA-N, 1lambda6-thiomorpholine-1,1-dione, ACT01985, ALBB-008692, BCP14326, KS-00000JT9, STR08569, ZX-AN007594, ZX-AT005232, ZX-CM012470, 1,1-DIOXO-1-THIOMORPHOLINE, ANW-29015, CT-497, MFCD05861623, SBB010267, STK505504, ZINC19737039, 1lambda~6~,4-thiazinane-1,1-dione, AKOS000321448, AM84924, CM13979, CS-W009111, FCH2582880, MCULE-9457378592, OR13966, PB18693, PS-3698, RP01064, SB10344, TRA0014617, VZ33874, 1$l^{6},4-thiomorpholine-1,1-dione, ACM39093931, AC-23959, AJ-74756, BC207358, CC-35003, FS001260, SC-04097, SY002390, AB0091193, AB1006725, AX8002384, DB-049372, RT-002517, ST4143474, TX-018018, BB 0259349, FT-0639524, ST24050169, MFCD05861623 (98%), Q-1053, 093T931, C-01584, I09-0986, J-524949, null, ACN-037123, CID6484228, T2193, 55160-66-2,

Complexity	143
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	135.035g/mol
Formal Charge	0
Heavy Atom Count	8
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	135.181g/mol
Monoisotopic Mass	135.035g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	54.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.1

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number