AG000E2V

1172986-17-2 | 4-Amino-6-bromothiochroman 1,1-dioxide hydrochloride

AG000E2V

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CAS Number	1172986-17-2
Catalog Number	AG000E2V(AGN-PC-0PA9Y4)
Chemical Name	4-Amino-6-bromothiochroman 1,1-dioxide hydrochloride
IUPAC Name	6-bromo-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine;hydrochloride
InChI	InChI=1S/C9H10BrNO2S.ClH/c10-6-1-2-9-7(5-6)8(11)3-4-14(9,12)13;/h1-2,5,8H,3-4,11H2;1H
InChI Key	WJWWQTOZSPMWQL-UHFFFAOYSA-N
MDL Number	MFCD11616744
Molecular Formula	C9H11BrClNO2S
Molecular Weight	312.6111
SMILES	BrC1=CC(C(N)CCS2(=O)=O)=C2C=C1.[H]Cl
Synonyms	1172986-17-2, 4-Amino-6-bromothiochroman 1,1-dioxide hydrochloride, 6-Bromo-3,4-dihydro-2H-S,S-dioxo-thiochromen-4-amine HCl, 6-bromo-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine;hydrochloride, 6-Bromo-3,4-dihydro-2H-S,S-Di-oxo-thiochromen-4-amine hydrochloride, 6-Bromo-3,4-dihydro-2H-S,S-dioxo-thiochromen-4-amine hydrochloride, PubChem14611, AC1Q3D2V, 6-Bromo-3,4-dihydro-2H-sulfonyl-4-amine hydrochloride, CTK8B5354, DTXSID20656846, BCP19277, ANW-48449, MFCD11616744, SC1211, AKOS008124771, 4-amino-6-bromo-3,4-dihydro-2H-1, MCULE-4452395585, RP09371, AK-28409, BR-28409, DS-11004, TR-006287, CS-0060641, FT-0685677, ST24028883, X9199, EN300-70169, S-6403, J-518358, W-204937, 4-amino-6-bromothiochromane 1,1-dioxide hydrochloride, 6-BROMO-3,4-DIHYDRO-2H-SULFONYL-4-AMINE HCL, Z1222331453, 6-Bromo-3,4-dihydro-2H-S,S-Di-oxo-thiochromen-4-amine HCl, 6-Bromo-3,4-dihydro-2h-s,s-di-oxo-thiochromen-4-amine, HCl, 4-Amino-6-bromo-3,4-dihydro-2H-S,S-dioxothiochromene Hydrochloride, 4-amino-6-bromo-3,4-dihydro-2H-1??-benzothiopyran-1,1-dione hydrochloride, 4-Amino-6-bromo-3,4-dihydro-2H-S,S-dioxo-thiochromene hydrochloride, 2H-1-Benzothiopyran-4-amine, 6-bromo-3,4-dihydro-, 1,1-dioxide, hydrochloride (1:1), 4-Amino-6-bromo-3,4-dihydro-1-benzothiopyran-1,1(2H)-dione--hydrogen chloride (1/1), 4-amino-6-bromo-3,4-dihydro-2H-1$l^{6}-benzothiopyran-1,1-dione hydrochloride, 4-amino-6-bromo-3,4-dihydro-2H-1lambda-benzothiopyran-1,1-dione hydrochloride, 4-amino-6-bromo-3,4-dihydro-2H-1lambda6-benzothiopyran-1,1-dione hydrochloride, C9H11BrClNO2S, 4-Amino-6-bromothiochroman1,1-dioxidehydrochloride, 4-Amino-N-(3-methoxy-2-pyrazinyl)-benzenesulfonamide, 916420-34-3, 152-47-6,

Complexity	311
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	310.938g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	312.606g/mol
Monoisotopic Mass	310.938g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	68.5A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0

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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