6-Thiocyanatobenzo[d]thiazol-2-amine

About 6-Thiocyanatobenzo[d]thiazol-2-amine

6-Thiocyanatobenzo[d]thiazol-2-amine is an impurity of Riluzole carrying the CAS registry number 7170-77-6. With the molecular formula C8H5N3S2, it has a molar mass of 207.3 g/mol. Systematically, it is named (2-amino-1,3-benzothiazol-6-yl) thiocyanate. Alternative names: 2-Amino-6-thiocyanatobenzothiazole and 2-Amino-6-benzothiazolyl thiocyanate.

It is supplied as a solid. Store the standard in its sealed vial, protected from light and moisture, and follow the storage condition printed on the COA. Under GHS it is labelled “Warning”, so handle it with suitable PPE and consult the SDS.

Pharmaceutical QC and development laboratories use this impurity standard of Riluzole to develop and validate HPLC methods, to set specification limits and to document impurity profiles in ANDA and DMF submissions. Our customers for this product work in pharmaceutical manufacturing and academic and industrial research.

We offer 6-Thiocyanatobenzo[d]thiazol-2-amine in 10 mg, 25 mg, 50 mg and 100 mg packs with a batch-specific COA, and ship to customers worldwide.

Typical applications

Analytical method development
Method validation (AMV)
QC release testing
ANDA / DMF filings

Industries

Related to Riluzole

View every impurity, metabolite and intermediate we list for Riluzole.

Riluzole impurities

Specifications & identifiers

Chemical identifiers
Product name	6-Thiocyanatobenzo[d]thiazol-2-amine
Catalogue No.	VQ-041913
CAS Number	7170-77-6
IUPAC name	(2-amino-1,3-benzothiazol-6-yl) thiocyanate
Molecular formula	C₈H₅N₃S₂
Molecular weight	207.3 g/mol
Exact mass	206.9925
Grade	Reference Standard
HSN code	38229090
InChIKey	FVNSRFMQXKMHTQ-UHFFFAOYSA-N
SMILES	C1=CC2=C(C=C1SC#N)SC(=N2)N
PubChem CID	81600

Physical properties
Physical form	Solid
LogP (XLogP3)	2.6
H-bond donors / acceptors	1 / 5
TPSA	116 Å²
Synonyms	Thiocyanic acid, 2-amino-6-benzothiazolyl ester, 2-Amino-6-thiocyanatobenzothiazole, 2-Amino-6-benzothiazolyl thiocyanate, 2-Amino-6-thiocyanato-1,3-benzothiazole, 2-Amino-6-thiocyanobenzothiazole, 2-amino-1,3-benzothiazol-6-yl thiocyanate, [(2-amino-1,3-benzothiazol-6-yl)sulfanyl]formonitrile, 2-amino-6-thiocyanato benzothiazole, 2-amino-6-thiocyanato-benzothiazole, 6-thiocyanatobenzothiazol-2-ylamine, (2-aminobenzothiazol-6-yl)thiocarbonitrile, 2-Imino-2,3-dihydro-1,3-benzothiazol-6-yl thiocyanate

Safety & hazard information (GHS)

Harmful / irritant

Signal word: Warning

Hazard statements

H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation

Precautionary statements: P261, P264, P264 + P265, P271, P280, P302 + P352, P304 + P340, P305 + P351 + P338, P319, P321, P332 + P317, P337 + P317, P362 + P364, P403 + P233, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of 6-Thiocyanatobenzo[d]thiazol-2-amine?

The CAS Registry Number of 6-Thiocyanatobenzo[d]thiazol-2-amine is 7170-77-6. It is also known as Thiocyanic acid, 2-amino-6-benzothiazolyl ester, 2-Amino-6-thiocyanatobenzothiazole, 2-Amino-6-benzothiazolyl thiocyanate.

What is the molecular formula and molecular weight of 6-Thiocyanatobenzo[d]thiazol-2-amine?

6-Thiocyanatobenzo[d]thiazol-2-amine has the molecular formula C8H5N3S2 and a molecular weight of 207.3 g/mol. Its IUPAC name is (2-amino-1,3-benzothiazol-6-yl) thiocyanate.

What is 6-Thiocyanatobenzo[d]thiazol-2-amine used for?

6-Thiocyanatobenzo[d]thiazol-2-amine is supplied as a characterised reference material related to Riluzole. It is used for analytical method development and validation (AMV), impurity profiling, stability studies and quality control, and in ANDA/DMF regulatory filings.

Which grade and pack sizes of 6-Thiocyanatobenzo[d]thiazol-2-amine can I order?

We supply 6-Thiocyanatobenzo[d]thiazol-2-amine in Reference Standard grade, in 10 mg, 25 mg, 50 mg, 100 mg packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with 6-Thiocyanatobenzo[d]thiazol-2-amine?

Yes. Every lot of 6-Thiocyanatobenzo[d]thiazol-2-amine is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can 6-Thiocyanatobenzo[d]thiazol-2-amine be shipped internationally?

Yes. 6-Thiocyanatobenzo[d]thiazol-2-amine is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.