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CAS 7716-66-7
Also known as: 7716-66-7, 3-chlorobenzo[d]isothiazole, 3-chloro-1,2-benzothiazole, 3-chlorobenzisothiazole, 1,2-benzisothiazole, 3-chloro-, Mfcd00673254
Molecular Formula
C7H4ClNS
Molecular Weight
169.63  g/mol
InChI Key
BCPVKLRBQLRWDQ-UHFFFAOYSA-N

1 2D Structure

CAS 7716-66-7

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
3-chloro-1,2-benzothiazole
2.1.2 InChI
InChI=1S/C7H4ClNS/c8-7-5-3-1-2-4-6(5)10-9-7/h1-4H
2.1.3 InChI Key
BCPVKLRBQLRWDQ-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C2C(=C1)C(=NS2)Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 7716-66-7

2. 3-chlorobenzo[d]isothiazole

3. 3-chloro-1,2-benzothiazole

4. 3-chlorobenzisothiazole

5. 1,2-benzisothiazole, 3-chloro-

6. Mfcd00673254

7. 3-chloro-benzo[d]isothiazole

8. 3-chloro-1,2-benzoisothiazole

9. 3-chlorobenzo[d]isothia-zole

10. Schembl291121

11. 3-chlorobenzoisothiazole

12. 3-chloro-(1,2-benzisothiazole)

13. Dtxsid20344599

14. Hms1732n07

15. Zinc2380704

16. Ac-224

17. Bbl010761

18. Stk576537

19. Akos000117368

20. Am10684

21. At19018

22. Cs-w016032

23. Ps-4455

24. Sb14698

25. Sy050239

26. Db-050606

27. A9771

28. Bb 0216396

29. C1991

30. Ft-0615291

31. En300-10958

32. 716c667

33. Q-200367

34. F0001-1985

35. 3-chlorobenzo[d]isothiazole;3-chloro-1,2-benzoisothiazole

2.3 Create Date
2005-03-27
3 Chemical and Physical Properties
Molecular Weight 169.63 g/mol
Molecular Formula C7H4ClNS
XLogP33.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count0
Exact Mass168.9752980 g/mol
Monoisotopic Mass168.9752980 g/mol
Topological Polar Surface Area41.1 Ų
Heavy Atom Count10
Formal Charge0
Complexity131
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
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118307-04-3
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, ...
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, Storage Fine Chemical Company in India which have specialty in Synthesis Molecules & Chemical Preparation. We are Bulk Drugs and Chemical manufactures, Suppliers and Exporters. We have very strong team of Technocrats & Technical People engaged mainly into the New Molecules for various Multinational Companies. The company is now aimed towards the International Market & as our first step to it, we have started implementation of ISO 9001:2000 which is expected to be completed by end of 2002.
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87691-88-1
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, ...
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, Storage Fine Chemical Company in India which have specialty in Synthesis Molecules & Chemical Preparation. We are Bulk Drugs and Chemical manufactures, Suppliers and Exporters. We have very strong team of Technocrats & Technical People engaged mainly into the New Molecules for various Multinational Companies. The company is now aimed towards the International Market & as our first step to it, we have started implementation of ISO 9001:2000 which is expected to be completed by end of 2002.
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118289-55-7
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, ...
Ramdev Chemicals Pvt. Ltd. is one of the fastest growing Active Pharmaceuticl Drugs, Drug Intermediates, Storage Fine Chemical Company in India which have specialty in Synthesis Molecules & Chemical Preparation. We are Bulk Drugs and Chemical manufactures, Suppliers and Exporters. We have very strong team of Technocrats & Technical People engaged mainly into the New Molecules for various Multinational Companies. The company is now aimed towards the International Market & as our first step to it, we have started implementation of ISO 9001:2000 which is expected to be completed by end of 2002.
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Royal pharma was started in 2007 – it’s a small scale Advanced Intermediates Manufacturing company. F...
Royal pharma was started in 2007 – it’s a small scale Advanced Intermediates Manufacturing company. Facilities are in accordance to GMP standards. Currently working with Indian Multinational companies and also with European countries. Its an ISO 9001:2000 certified company. Facilities are in accordance to GMP standards. Currently working with Indian Multinational companies and also with European countries. Facilities are in accordance to GMP standards.
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87691-87-0
Royal pharma was started in 2007 – it’s a small scale Advanced Intermediates Manufacturing company. F...
Royal pharma was started in 2007 – it’s a small scale Advanced Intermediates Manufacturing company. Facilities are in accordance to GMP standards. Currently working with Indian Multinational companies and also with European countries. Its an ISO 9001:2000 certified company. Facilities are in accordance to GMP standards. Currently working with Indian Multinational companies and also with European countries. Facilities are in accordance to GMP standards.
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46022-05-3
Sandoo Pharmaceuticals and Chemcials Co.,Ltd was established in 2009, with a young and active team, locat...
Sandoo Pharmaceuticals and Chemcials Co.,Ltd was established in 2009, with a young and active team, located in Ningbo, China. Specializes in exporting and importing pharmaceutical intermediates and chemical products as well as active pharmaceutical ingredients.
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We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with ...
We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with a professional approach that is aimed at finest results. We have etched a respectable place in the industry with proven expertise in manufacturing a wide spectrum of products. Vijayasri today is one of the prominent manufacturers of Active Pharmaceutical Ingredients (API) and intermediates. Our excellent Performance in Contract manufacturing over the years has also earned us the status of a trustable name in the pharmaceutical industry.
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56341-37-8
We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with ...
We introduce ourselves as manufacturer of Active Pharmaceutical Ingredients (API) and intermediates with a professional approach that is aimed at finest results. We have etched a respectable place in the industry with proven expertise in manufacturing a wide spectrum of products. Vijayasri today is one of the prominent manufacturers of Active Pharmaceutical Ingredients (API) and intermediates. Our excellent Performance in Contract manufacturing over the years has also earned us the status of a trustable name in the pharmaceutical industry.
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2746-19-2
Xi'an caijing opto-Electrical Science & Technology Co.,Ltd.(briefed as CJOE), located in Xi'an High-Tech ...
Xi'an caijing opto-Electrical Science & Technology Co.,Ltd.(briefed as CJOE), located in Xi'an High-Tech Development Zone with a registered capital of 90 million Yuan, is a high-tech joint-stock enterprise and has been engaged in manufacture, R & D and trade. Our major investors are well-known domestic institute and companies including: Xi'an Modern Chemistry Research Institute, Xi'an DongFang Group.,Ltd, Beijing Minghang Science & Technology Development Co., Ltd. etc. We have the self-supported import and export right and our business is dedicated to liquid crystal display materials, organic electroluminescent materials and fine chemicals.
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