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CAS 131020-57-0
Also known as: 131020-57-0, 4,5,6,7-tetrahydro-1h-benzo[d]imidazole-5-carboxylic acid hydrochloride, 4,5,6,7-tetrahydrobenzimidazole-5-carboxylic acid hydrochloride, 4,5,6,7-tetrahydro-1h-1,3-benzodiazole-5-carboxylic acid hydrochloride, 4,5,6,7-tetrahydro-1h-benzoimidazole-5-carboxylic acid, hcl, 4,5,6,7-tetrahydro-3h-benzimidazole-5-carboxylic acid;hydrochloride
Molecular Formula
C8H11ClN2O2
Molecular Weight
202.64  g/mol
InChI Key
HCLOFQMHYZETCL-UHFFFAOYSA-N

1 2D Structure

CAS 131020-57-0

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
4,5,6,7-tetrahydro-3H-benzimidazole-5-carboxylic acid;hydrochloride
2.1.2 InChI
InChI=1S/C8H10N2O2.ClH/c11-8(12)5-1-2-6-7(3-5)10-4-9-6;/h4-5H,1-3H2,(H,9,10)(H,11,12);1H
2.1.3 InChI Key
HCLOFQMHYZETCL-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CC2=C(CC1C(=O)O)NC=N2.Cl
2.2 Synonyms
2.2.1 Depositor-Supplied Synonyms

1. 131020-57-0

2. 4,5,6,7-tetrahydro-1h-benzo[d]imidazole-5-carboxylic Acid Hydrochloride

3. 4,5,6,7-tetrahydrobenzimidazole-5-carboxylic Acid Hydrochloride

4. 4,5,6,7-tetrahydro-1h-1,3-benzodiazole-5-carboxylic Acid Hydrochloride

5. 4,5,6,7-tetrahydro-1h-benzoimidazole-5-carboxylic Acid, Hcl

6. 4,5,6,7-tetrahydro-3h-benzimidazole-5-carboxylic Acid;hydrochloride

7. Mfcd18157694

8. 4,5,6,7-tetrahydro-1h-benzo[d]imidazole-5-carboxylic Acid Hcl

9. 4,5,6,7-tetrahydro-1h-benzo[d]imidazole-6-carboxylic Acid Hcl

10. 4,5,6,7-tetrahydrobenzimidazole-5-carboxylic Acid Hcl

11. Schembl3184832

12. Chembl1773949

13. Dtxsid10692839

14. Amy15263

15. Bcp14715

16. Akos015919913

17. Cs-w003894

18. Ds-0707

19. Fd17082

20. Ac-26298

21. Sy026670

22. A847880

23. F2147-1872

24. Z1741975324

25. (+)-4,5,6,7-tetrahydrobenzimidazole-5-carboxylic Acid Hydrochloride

26. 4,5,6,7-tetrahydrobenzimidazole-5-carboxylic Acid Hydro-chloride

27. 4,5,6,7-tetrahydro-1h-benzimidazole-5-carboxylic Acid Hydrochloride (1:1)

28. 4,5,6,7-tetrahydro-1h-benzimidazole-5-carboxylic Acid, Hydrochloride

29. 4,5,6,7-tetrahydro-1h-benzimidazole-5-carboxylic Acid, Hydrochloride Salt

30. 4,5,6,7-tetrahydro-1h-benzo[d]imidazole-5-carboxylicacidhydrochloride

31. 1h-benzimidazole-6-carboxylic Acid, 4,5,6,7-tetrahydro-, Hydrochloride (1:1)

32. 4,5,6,7-tetrahydro-1h-benzimidazole-6-carboxylic Acid--hydrogen Chloride (1/1)

33. 4,5,6,7-tetrahydro-1h-benzoimidazole-5-carboxylic Acid Hydrochloride;4,5,6,7-tetrahydrobenzimidazole-5-carboxylic Acid Hydrochloride

2.3 Create Date
2011-06-27
3 Chemical and Physical Properties
Molecular Weight 202.64 g/mol
Molecular Formula C8H11ClN2O2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass202.0509053 g/mol
Monoisotopic Mass202.0509053 g/mol
Topological Polar Surface Area66 Ų
Heavy Atom Count13
Formal Charge0
Complexity196
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
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ESTECHPHARMA CO.,LTD., as one of the active pharmaceutical company, is remarkably growing more than 30% e...
ESTECHPHARMA CO.,LTD., as one of the active pharmaceutical company, is remarkably growing more than 30% every year by concentrating all our efforts into developing new technologies by investing more than 15% of the annual turnover into R&D since our foundation in 1996. That is company ideology, challenge and creation. We've succeeded in synthesizing 40 kinds of APIs like Anti-inflammatory medicine, Anti-ulcerants, Anti-hepatitis, Treatments of Alcoholism, and etc secondly or thirdly in the world or firstly in Korea, and have been producing and supplying continuously to our customers.
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Suraj Laboratories Private Limited, established in 2021, is a pharmaceutical firm providing Contract Rese...
Suraj Laboratories Private Limited, established in 2021, is a pharmaceutical firm providing Contract Research and Manufacturing Services (CRAMS), Custom Synthesis, and cGMP scale manufacturing services necessary for the large-scale production of Active Pharmaceutical Ingredients (APIs), Saleable Intermediates for APIs, and Key Starting Materials (KSMs). It operates as a specialized pharmaceutical bulk drug manufacturing entity located in India.
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