AG000LQD

Name: 6-Bromo-5-cyano-2-mercaptobenzothiazole
Brand: Angene Chemical
SKU: AG000LQD

1242336-64-6 | 6-Bromo-5-cyano-2-mercaptobenzothiazole

AG000LQD

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CAS Number	1242336-64-6
Catalog Number	AG000LQD(AGN-PC-0WABUT)
Chemical Name	6-Bromo-5-cyano-2-mercaptobenzothiazole
IUPAC Name	6-bromo-2-sulfanylidene-3H-1,3-benzothiazole-5-carbonitrile
InChI	InChI=1S/C8H3BrN2S2/c9-5-2-7-6(1-4(5)3-10)11-8(12)13-7/h1-2H,(H,11,12)
InChI Key	PXRUSVYIVKWKOL-UHFFFAOYSA-N
MDL Number	MFCD16660295
Molecular Formula	C8H3BrN2S2
Molecular Weight	271.1568
SMILES	N#Cc1cc2[nH]c(=S)sc2cc1Br
Synonyms	6-BROMO-5-CYANO-2-MERCAPTOBENZOTHIAZOLE, 1242336-64-6, ACMC-209ar9, C8H3BrN2S2, CTK4B3805, DTXSID90682076, ANW-18211, MFCD16660295, ZINC65337248, AKOS015835944, TR-035032, Z8762, B-2802, I01-11241, 5-Benzothiazolecarbonitrile, 6-bromo-2,3-dihydro-2-thioxo-, 6-Bromo-2-sulfanylidene-2,3-dihydro-1,3-benzothiazole-5-carbonitrile, 6-Bromo-2-mercaptobenzo[d]thiazole-5-carbonitrile,

Complexity	285
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	269.892g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	271.15g/mol
Monoisotopic Mass	269.892g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	93.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.7

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited