2-(Carboxymethylthio)Benzothiazole

Modify Date: 2025-08-20 11:36:27

2-(Carboxymethylthio)Benzothiazole structure	Common Name	2-(Carboxymethylthio)Benzothiazole
	CAS Number	6295-57-4	Molecular Weight	225.287
	Density	1.5±0.1 g/cm3	Boiling Point	423.4±47.0 °C at 760 mmHg
	Molecular Formula	C₉H₇NO₂S₂	Melting Point	159°C
	MSDS	N/A	Flash Point	209.9±29.3 °C

Name	(2-Benzothiazolylthio)acetic Acid
Synonym	More Synonyms

Density	1.5±0.1 g/cm3
Boiling Point	423.4±47.0 °C at 760 mmHg
Melting Point	159°C
Molecular Formula	C₉H₇NO₂S₂
Molecular Weight	225.287
Flash Point	209.9±29.3 °C
Exact Mass	224.991821
PSA	103.73000
LogP	2.74
Vapour Pressure	0.0±1.1 mmHg at 25°C
Index of Refraction	1.727
InChIKey	ZZUQWNYNSKJLPI-UHFFFAOYSA-N
SMILES	O=C(O)CSc1nc2ccccc2s1

2-(Carboxymethylthio)Benzothiazole MSDS(Chinese)

Hazard Codes	Xi
Risk Phrases	R36/37/38
Safety Phrases	S26-S36/37/39
HS Code	2934999090

2-Mercaptobenzo...

CAS#:149-30-4

Chloroacetic acid

CAS#:79-11-8

~82%

2-(Carboxymethy...

CAS#:6295-57-4

Literature: Bakhareva; Voronkov; Sorokin; Lopyrev; Seredenin; Gaidarov Pharmaceutical Chemistry Journal, 1996 , vol. 30, # 2 p. 89 - 91

ethyl 2-(benzo[...

CAS#:24044-88-0

~95%

2-(Carboxymethy...

CAS#:6295-57-4

Literature: Giesbrecht, Heath E.; Knight, Brian J.; Tanguileg, Nicole R.; Emerson, Christopher R.; Blakemore, Paul R. Synlett, 2010 , # 3 art. no. S12009ST, p. 374 - 378

ethyl 2-bromoacetate

CAS#:105-36-2

2-Mercaptobenzo...

CAS#:149-30-4

2-(Carboxymethy...

CAS#:6295-57-4

Literature: Monatshefte fur Chemie, , vol. 131, # 9 p. 937 - 943

Sodium 2-Mercap...

CAS#:2492-26-4

2-(Carboxymethy...

CAS#:6295-57-4

Literature: Pharmazie, , vol. 54, # 3 p. 229 - 231

2-Mercaptobenzo...

CAS#:149-30-4

2-(Carboxymethy...

CAS#:6295-57-4

Literature: WO2013/128465 A1, ;

Bromoacetic acid

CAS#:79-08-3

2-Mercaptobenzo...

CAS#:149-30-4

2-(Carboxymethy...

CAS#:6295-57-4

Literature: European Journal of Medicinal Chemistry, , vol. 76, p. 274 - 283

2(3H)-Benzothia...

CAS#:7778-70-3

potassium monoc...

CAS#:7748-25-6

2-(Carboxymethy...

CAS#:6295-57-4

Literature: DE638345 , ; Fortschr. Teerfarbenfabr. Verw. Industriezweige, vol. 23, p. 1490,1493

Precursor 7
CAS#:149-30-4 2-Mercaptobenzo... CAS#:79-11-8 Chloroacetic acid CAS#:105-36-2 ethyl 2-bromoacetate CAS#:2492-26-4 Sodium 2-Mercap...
CAS#:79-08-3 Bromoacetic acid CAS#:7778-70-3 2(3H)-Benzothia... CAS#:7748-25-6 potassium monoc...
DownStream 5
CAS#:24044-91-5 Aceticacid, 2-(... CAS#:934-34-9 benzothiazolinone CAS#:66085-22-1 2-(1,3-benzothi... CAS#:80357-75-1 2-(1,3-benzothi...
CAS#:92137-10-5 Benzothiazole, ...

HS Code	2934999090
Summary	2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Name: Primary cell-based high-throughput screening assay for identification of compounds th...
Source: Johns Hopkins Ion Channel Center
Target: regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id: JHICC_RGS_Act_HTS

Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN

Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN

Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN

Name: uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
Source: Burnham Center for Chemical Genomics
Target: N/A
External Id: BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay

Name: Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
Source: ChEMBL
Target: Klebsiella pneumoniae
External Id: CHEMBL4296186

Name: High throughput fluorescence intensity-based biochemical assay to screen for small mo...
Source: University of Pittsburgh Molecular Library Screening Center
Target: furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id: MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.

Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity

Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity

Name: Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
Source: 24386
Target: N/A
External Id: Sarm1 TIR NADase inhibitors

Total 130, Current Page 1 of 13