Dalian Richon Chem

4CH-015700

Chemistry, 7 End Use API, 88 Related Intermediates

Manufacturers/Suppliers

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Also known as: 41263-74-5, 4-methylamino-3-nitrobenzoic acid, 4-methylamino-3-nitro-benzoic acid, Benzoic acid, 4-(methylamino)-3-nitro-, Mfcd00464322, 4-(methylamino)-3-nitrobenzoicacid

Molecular Formula

C₈H₈N₂O₄

Molecular Weight

196.16 g/mol

InChI Key

KSMLIIWEQBYUKA-UHFFFAOYSA-N

1 2D Structure

4CH-015700

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

4-(methylamino)-3-nitrobenzoic acid

2.1.2 InChI

InChI=1S/C8H8N2O4/c1-9-6-3-2-5(8(11)12)4-7(6)10(13)14/h2-4,9H,1H3,(H,11,12)

2.1.3 InChI Key

KSMLIIWEQBYUKA-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CNC1=C(C=C(C=C1)C(=O)O)[N+](=O)[O-]

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 41263-74-5

2. 4-methylamino-3-nitrobenzoic Acid

3. 4-methylamino-3-nitro-benzoic Acid

4. Benzoic Acid, 4-(methylamino)-3-nitro-

5. Mfcd00464322

6. 4-(methylamino)-3-nitrobenzoicacid

7. Nsc 138300

8. Nsc138300

9. Lead(ii)fluoride

10. Schembl321911

11. Chembl237731

12. Dtxsid20300675

13. 3-nitro-4-methylaminobenzoic Acid

14. 4-methylamino-3-nitro Benzoicacid

15. 4-methylamino-3-nitro Benzoic Acid

16. Bcp08906

17. Zinc3887891

18. Ac-596

19. Akos000214826

20. Akos015965483

21. Cs-w002629

22. Ds-1047

23. Nsc-138300

24. Bp-30015

25. Sy009730

26. Db-070164

27. A6844

28. Am20061057

29. Bb 0218125

30. Ft-0647367

31. M2423

32. En300-09753

33. 263m745

34. Ae-641/04642006

35. A1-00098

36. J-513766

2.3 Create Date

2005-03-26

3 Chemical and Physical Properties

Molecular Formula	C₈H₈N₂O₄
Molecular Weight	196.16 g/mol
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	196.04840674 g/mol
Monoisotopic Mass	196.04840674 g/mol
Topological Polar Surface Area	95.2 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	238
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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CAS Number

211915-84-3

End Use API

Dalian Richon Chem. Co., Ltd is a high-tech enterprise professionally involved in research and developmen...

Dalian Richon Chem. Co., Ltd is a high-tech enterprise professionally involved in research and development, manufacturing process and sales service of pharmaceutical intermediates and APIs. It has passed ISO9001:2000 international quality management system certificate. Its business scope includes development and manufacturing of APIs and pharmaceutical intermediates, contract development and manufacturing for domestic and international pharmaceutical companies, technical consultation, service and transfer.

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