Athena Athena

X

CAS 1975-51-5 manufacturers and suppliers on PharmaCompass

PharmaCompass
  • Chemistry
CAS 1975-51-5
Also known as: 1975-51-5, 4-nitro-o-toluic acid, 4-nitro-2-methylbenzoic acid, 2-methyl-4-nitro-benzoic acid, Benzoic acid, 2-methyl-4-nitro-, 2-methyl-4-nitrobenzoicacid
Molecular Formula
C8H7NO4
Molecular Weight
181.15  g/mol
InChI Key
XXXOBNJIIZQSPT-UHFFFAOYSA-N
FDA UNII
N5G57JE9C2

1 2D Structure

CAS 1975-51-5

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-methyl-4-nitrobenzoic acid
2.1.2 InChI
InChI=1S/C8H7NO4/c1-5-4-6(9(12)13)2-3-7(5)8(10)11/h2-4H,1H3,(H,10,11)
2.1.3 InChI Key
XXXOBNJIIZQSPT-UHFFFAOYSA-N
2.1.4 Canonical SMILES
CC1=C(C=CC(=C1)[N+](=O)[O-])C(=O)O
2.2 Other Identifiers
2.2.1 UNII
N5G57JE9C2
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 1975-51-5

2. 4-nitro-o-toluic Acid

3. 4-nitro-2-methylbenzoic Acid

4. 2-methyl-4-nitro-benzoic Acid

5. Benzoic Acid, 2-methyl-4-nitro-

6. 2-methyl-4-nitrobenzoicacid

7. N5g57je9c2

8. Mfcd00210697

9. Nsc-227948

10. Einecs 217-828-5

11. Nsc227948

12. 2-methyl4-nitrobenzoic Acid

13. Unii-n5g57je9c2

14. Schembl33664

15. 2-methyl-4-nitrobenzic Acid

16. 4-nitro-2-methyl-benzoic Acid

17. Dtxsid90173434

18. 2-methyl-4-nitrobenzoic Acid (en)

19. Act01040

20. Bcp24523

21. Zinc1757885

22. Cl8053

23. Stk450324

24. 2-methyl-4-nitrobenzoic Acid, 97%

25. Akos003374875

26. Ac-3270

27. Cs-w017164

28. Nsc 227948

29. Ps-5539

30. Sy004716

31. Db-024347

32. Am20060333

33. Ft-0647571

34. En300-56060

35. 975m515

36. Ae-562/43336073

37. W-201730

38. Z1259040960

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 181.15 g/mol
Molecular Formula C8H7NO4
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass181.03750770 g/mol
Monoisotopic Mass181.03750770 g/mol
Topological Polar Surface Area83.1 Ų
Heavy Atom Count13
Formal Charge0
Complexity223
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
Flag China
Digital Content Digital Content
URL Supplier Web Content
1975-51-5
Shouyuan chemical (one of the leading chemicals supplier in China) specializes in manufacturing, supplyin...
Shouyuan chemical (one of the leading chemicals supplier in China) specializes in manufacturing, supplying, and custom synsthesis latest chemicals. Our products cover all kinds of range like pharmaceuticals, agrochemicals, electronic chemicals, surfactants and other specialty chemicals.
ASK
US
PHARMACOMPASS
Upload
your Marketing & Sales content
Ask Us for Pharmaceutical Supplier and Partner
Ask Us, Find A Supplier / Partner
No Commissions, No Strings Attached, Get Connected for FREE

What are you looking for?

How can we help you?

The request can't be empty

Please read our Privacy Policy carefully

You must agree to the privacy policy

The name can't be empty
The company can't be empty.
The email can't be empty Please enter a valid email.
The mobile can't be empty
Post Enquiry
POST ENQUIRY