Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate | CAS No. 729590-69-6

Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate

Basic Information

CAS Number

729590-69-6

Molecular Formula

C10H12BrNO2S

Molecular Weight

290.18 g/mol

AD

Basic Physical Properties

CCOC(=O)C1CCCC2=C1N=C(S2)Br

InChI

InChI=1S/C10H12BrNO2S/c1-2-14-9(13)6-4-3-5-7-8(6)12-10(11)15-7/h6H,2-5H2,1H3

InChIKey

GVFHKLWRMWXOLM-UHFFFAOYSA-N

LogP

2.888600000000002

Topological Polar Surface Area

39.19 Ų

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

252

Synonyms & References

English

  • 2-Bromo-4,5,6,7-tetrahydrobenzothiazole-4-carboxylic acid ethyl ester
  • BS-29373
  • 2-Bromo-4,5,6,7-tetrahydro-benzothiazole-4-carboxylic acid ethyl ester
  • SCHEMBL3929167
  • ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate
  • EN300-3384392
  • Ethyl2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazole-4-carboxylate
  • Ethyl 2-bromo-4,5,6,7-tetrahydrobenzo[d]thiazole-4-carboxylate
  • DTXSID60726390
  • G10172
  • 729590-69-6
  • 2-BroMo-4,5,6,7-tetrahydro-benzothiazole-4-carboxylic acid ethyl ester

MDL Number

MFCD22565626

FAQ

What regulatory guidelines apply to Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6)?

Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6) is subject to GHS classification, REACH regulations, and FDA/EPA guidelines for chemical handling and disposal. Regulatory requirements include proper labeling, reporting of chemical usage, and compliance with safety data sheets (SDS).

Are there alternatives to Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate in synthesis?

Alternatives to Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate include various brominated benzothiazole derivatives and other thiophene-containing compounds. Common alternative reagents include 2-bromo-4,5,6,7-tetrahydro-1,3-benzoxazole-4-carboxylic acid and similar bromine-containing thiophene derivatives.

What is the market or research trend for Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6)?

The market for Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6) is growing due to its use in pharmaceuticals and organic synthesis. Research trends include the development of new synthetic routes and applications in medicinal chemistry, with a focus on drug discovery and novel therapeutics.

How should waste containing Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6) be handled?

Waste containing Ethyl 2-bromo-4,5,6,7-tetrahydro-1,3-benzothiazole-4-carboxylate (CAS: 729590-69-6) should be collected in proper containers and disposed of through incineration or professional waste disposal services. Environmental protection precautions include proper containment to prevent spills, and adherence to local and national waste management regulations.

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