CAS 88-14-2

Chemistry, 4 End Use API, 18 Related Intermediates

Manufacturers/Suppliers

4 Suppliers

4 Suppliers

Also known as: Furan-2-carboxylic acid, 88-14-2, 2-furancarboxylic acid, Pyromucic acid, 2-carboxyfuran, Furancarboxylic acid

Molecular Formula

C₅H₄O₃

Molecular Weight

112.08 g/mol

InChI Key

SMNDYUVBFMFKNZ-UHFFFAOYSA-N

FDA UNII

P577F6494A

furoic acid is a natural product found in Aloe africana, Osbeckia chinensis, and other organisms with data available.

1 2D Structure

CAS 88-14-2

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

furan-2-carboxylic acid

2.1.2 InChI

InChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)

2.1.3 InChI Key

SMNDYUVBFMFKNZ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=COC(=C1)C(=O)O

2.2 Other Identifiers

2.2.1 UNII

P577F6494A

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-furancarboxylic Acid

2. 2-furoic Acid, Sodium Salt

3. Furan-2-carboxylate

4. Furan-2-ylacetate

5. Furan-3-carboxylic

2.3.2 Depositor-Supplied Synonyms

1. Furan-2-carboxylic Acid

2. 88-14-2

3. 2-furancarboxylic Acid

4. Pyromucic Acid

5. 2-carboxyfuran

6. Furancarboxylic Acid

7. Furoic Acid

8. Alpha-furoic Acid

9. 2-furanoic Acid

10. Alpha-furancarboxylic Acid

11. 26447-28-9

12. Kyselina 2-furoova

13. Kyselina Pyroslizova

14. .alpha.-furoic Acid

15. Nsc 8842

16. .alpha.-furancarboxylic Acid

17. Mfcd00003238

18. Chebi:30845

19. Nsc-8842

20. P577f6494a

21. Kyselina 2-furoova [czech]

22. Kyselina Pyroslizova [czech]

23. Ccris 2157

24. Nsc-58965

25. Einecs 201-803-0

26. Einecs 247-713-5

27. Brn 0110149

28. Pyromucate

29. Furoate

30. Furoica

31. Furanoic Acid

32. Furancarboxylate

33. Alpha-furoate

34. Furic Acid

35. Beta-furoate

36. 2-furoic Acid [per Einecs]

37. Ai3-16500

38. A-furoate

39. B-furoate

40. 2-furoicacid

41. A-furoic Acid

42. B-furoic Acid

43. Acido 2-furoico

44. Beta-furoic Acid

45. Unii-p577f6494a

46. 2-furanoate

47. A-furancarboxylate

48. Acide 2-furoique

49. B-furancarboxylate

50. Furancarbonylic Acid

51. Beta-furancarboxylate

52. Furan-2-carbonsaeure

53. Alpha-furancarboxylate

54. A-furancarboxylic Acid

55. B-furancarboxylic Acid

56. Furan-2-carboxylicacid

57. Furoic Acid (related)

58. 2-furanecarboxylic Acid

59. 2-furan Carboxylic Acid

60. Beta-furancarboxylic Acid

61. Furane-2-carboxylic Acid

62. 2-furoic Acid, 98%

63. Furancarboxylic Acid-(2)

64. Bmse000330

65. Dsstox_cid_21420

66. Dsstox_rid_79724

67. Dsstox_gsid_41420

68. Schembl24446

69. 5-18-06-00102 (beilstein Handbook Reference)

70. 2-furoic Acid [mi]

71. Chembl1232797

72. Dtxsid6041420

73. Nsc8842

74. Zinc158555

75. 2-furoic Acid, Analytical Standard

76. Str01019

77. Wgc36563

78. Tox21_301128

79. Bbl009679

80. S4864

81. Stk256918

82. 2-furoic Acid [usp Impurity]

83. Akos000119036

84. Ccg-266054

85. Cs-w013662

86. Hy-w012946

87. Ps-3380

88. Cas-88-14-2

89. Ncgc00248301-01

90. Ncgc00255027-01

91. F0081

92. Ft-0612470

93. Ft-0777874

94. C01546

95. Ab00375923-02

96. Ac-907/25014051

97. Q2210953

98. W-100416

99. F9995-1642

100. Z256709158

2.4 Create Date

2004-09-16

3 Chemical and Physical Properties

Molecular Formula	C₅H₄O₃
Molecular Weight	112.08 g/mol
XLogP3	0.5
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	112.016043985 g/mol
Monoisotopic Mass	112.016043985 g/mol
Topological Polar Surface Area	50.4 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	99.8
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