AG005S92

97050-36-7 | Benzo[D]Isothiazol-6-Amine

AG005S92

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CAS Number	97050-36-7
Catalog Number	AG005S92(AGN-PC-01V59A)
Chemical Name	Benzo[D]Isothiazol-6-Amine
IUPAC Name	1,2-benzothiazol-6-amine
InChI	InChI=1S/C7H6N2S/c8-6-2-1-5-4-9-10-7(5)3-6/h1-4H,8H2
InChI Key	SFJKMYTWPTTZOS-UHFFFAOYSA-N
MDL Number	MFCD18804902
Molecular Formula	C7H6N2S
Molecular Weight	150.2009
SMILES	NC1=CC2=C(C=NS2)C=C1
Synonyms	Benzo[d]isothiazol-6-amine, 97050-36-7, 6-aminobenzoisothiazole, 1,2-BENZISOTHIAZOL-6-AMINE, 1,2-Benzothiazol-6-amine, SCHEMBL3709276, CTK3I6126, DTXSID90593214, MFCD18804902, ZINC82840474, AKOS022904258, FCH2493596, SY129143, AX8310680, MFCD18804902 (95%), 1,2-Benzisothiazol-6-amine (9CI), N,N-Dimethylbenzo[d]isothiazol-6-amine, 60768-67-4,

Complexity	129
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	150.025g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	150.199g/mol
Monoisotopic Mass	150.025g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	67.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

Lot Number