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Methyl 6-bromobenzo[d]thiazole-2-carboxylate - 96%, high purity , CAS No.1187928-41-1

COA

Grade & Purity:

≥96%

Cas Number: 1187928-41-1
Molecular Weight: 272.12
PubChem CID: 53408396

In stock

Item Number

M189947

Grouped product items
SKU	Size	Availability	Price
M189947-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$35.90
M189947-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$119.90
M189947-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$158.90
M189947-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$412.90
M189947-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,854.90
M189947-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$3,338.90

Discover Methyl 6-bromobenzo[d]thiazole-2-carboxylate by Aladdin Scientific in 96% for only $35.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	Methyl 6-bromobenzo[d]thiazole-2-carboxylate \| 1187928-41-1 \| methyl 6-bromo-1,3-benzothiazole-2-carboxylate \| 6-BROMO-BENZOTHIAZOLE-2-CARBOXYLIC ACID METHYL ESTER \| MFCD12913873 \| SCHEMBL20899481 \| DTXSID00696265 \| AKOS016005702 \| CS-W005826 \| DS-2526 \| SB31206 \| SY105406 \| Met
Specifications & Purity	≥96%
Storage Temp	Room temperature
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzothiazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzothiazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzothiazoles
Alternative Parents	Thiazolecarboxylic acids and derivatives Benzenoids Aryl bromides Methyl esters Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	1,3-benzothiazole - Thiazolecarboxylic acid or derivatives - Aryl bromide - Aryl halide - Benzenoid - Azole - Thiazole - Methyl ester - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	methyl 6-bromo-1,3-benzothiazole-2-carboxylate
INCHI	InChI=1S/C9H6BrNO2S/c1-13-9(12)8-11-6-3-2-5(10)4-7(6)14-8/h2-4H,1H3
InChIKey	YYRMISDDHIOACX-UHFFFAOYSA-N
Smiles	COC(=O)C1=NC2=C(S1)C=C(C=C2)Br
Isomeric SMILES	COC(=O)C1=NC2=C(S1)C=C(C=C2)Br
Molecular Weight	272.12
Reaxy-Rn	22807526
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=22807526&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	272.120 g/mol
XLogP3	3.300
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	270.93 Da
Monoisotopic Mass	270.93 Da
Topological Polar Surface Area	67.400 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	239.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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