CAS 7377-08-4

DRL offers a portfolio of products & services, including APIs, CMO services, generics, biosimilars & differentiated formulations.

Virtual Booth

Contact Supplier

Valsynthese, part of the SSE Group, is a CDMO focused on highly energetic and highly hazardous chemistry.

CHEMISTRY

Discover Molecule Insights

Chemistry

Click the arrow to open the dropdown

Click the button for full data set

Also known as: 7377-08-4, 3-[(4-aminobenzoyl)amino]propanoic acid, 3-(4-aminobenzamido)propanoic acid, 3-(4-amino-benzoylamino)-propionic acid, 4-aminobenzoyl-beta-alanine, 4-aminobenzoyl-(beta)-alanine

Molecular Formula

C₁₀H₁₂N₂O₃

Molecular Weight

208.21 g/mol

InChI Key

VHAXWROFYVPXMZ-UHFFFAOYSA-N

FDA UNII

AB85LJQ945

1 2D Structure

CAS 7377-08-4

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

3-[(4-aminobenzoyl)amino]propanoic acid

2.1.2 InChI

InChI=1S/C10H12N2O3/c11-8-3-1-7(2-4-8)10(15)12-6-5-9(13)14/h1-4H,5-6,11H2,(H,12,15)(H,13,14)

2.1.3 InChI Key

VHAXWROFYVPXMZ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC(=CC=C1C(=O)NCCC(=O)O)N

2.2 Other Identifiers

2.2.1 UNII

AB85LJQ945

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 4-aminobenzoyl-alanine

2. 4-aminobenzoyl-beta-alanine

2.3.2 Depositor-Supplied Synonyms

1. 7377-08-4

2. 3-[(4-aminobenzoyl)amino]propanoic Acid

3. 3-(4-aminobenzamido)propanoic Acid

4. 3-(4-amino-benzoylamino)-propionic Acid

5. 4-aminobenzoyl-beta-alanine

6. 4-aminobenzoyl-(beta)-alanine

7. Ab85ljq945

8. 3-(4-aminobenzoylamino)propionic Acid

9. 3-((4-aminobenzoyl)amino)propanoic Acid

10. N-[(4-aminophenyl)carbonyl]-beta-alanine

11. 3-[(4-aminophenyl)formamido]propanoic Acid

12. N-4-(aminobenzoyl)-beta-alanine

13. Unii-ab85ljq945

14. Schembl130343

15. P-amino-n-benzoyl-beta-alanine

16. Dtxsid30224136

17. N-(4-aminobenzoyl)-

18. ?-alanine

19. Chebi:174044

20. Zinc120074

21. Bcp18194

22. Beta-alanine, N-(p-aminobenzoyl)-

23. 3-(4-aminobenzamido)propionic Acid

24. Beta-alanine, N-(4-aminobenzoyl)-

25. N-(4-aminobenzoyl)- Beta -alanine

26. Bbl004484

27. Mfcd00009805

28. Stk898998

29. 4-aminobenzoyl-.beta.-alanine

30. Akos000120590

31. Bs-4182

32. Cs-w015221

33. Hy-w014505

34. Sb78189

35. P-amino-n-benzoyl-.beta.-alanine

36. Db-055799

37. N-(4-aminobenzoyl)-.beta.-alanine

38. Bb 0242973

39. Ft-0636462

40. .beta.-alanine, N-(4-aminobenzoyl)-

41. .beta.-alanine, N-(p-aminobenzoyl)-

42. D81824

43. A837917

44. Q27273840

2.4 Create Date

2005-07-08

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₁₂N₂O₃
Molecular Weight	208.21 g/mol
XLogP3	0
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	208.08479225 g/mol
Monoisotopic Mass	208.08479225 g/mol
Topological Polar Surface Area	92.4 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	235
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

CAS 7377-08-4 manufacturers and suppliers on PharmaCompass

CHEMISTRY

Discover Molecule Insights

What are you looking for?