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Chemistry

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Also known as: 93-58-3, Methylbenzoate, Benzoic acid, methyl ester, Benzoic acid methyl ester, Clorius, Niobe oil
Molecular Formula
C8H8O2
Molecular Weight
136.15  g/mol
InChI Key
QPJVMBTYPHYUOC-UHFFFAOYSA-N
FDA UNII
6618K1VJ9T

Methyl Benzoate
methyl benzoate is a natural product found in Vitis rotundifolia, Lonicera japonica, and other organisms with data available.
1 2D Structure

Methyl Benzoate

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
methyl benzoate
2.1.2 InChI
InChI=1S/C8H8O2/c1-10-8(9)7-5-3-2-4-6-7/h2-6H,1H3
2.1.3 InChI Key
QPJVMBTYPHYUOC-UHFFFAOYSA-N
2.1.4 Canonical SMILES
COC(=O)C1=CC=CC=C1
2.2 Other Identifiers
2.2.1 UNII
6618K1VJ9T
2.3 Synonyms
2.3.1 Depositor-Supplied Synonyms

1. 93-58-3

2. Methylbenzoate

3. Benzoic Acid, Methyl Ester

4. Benzoic Acid Methyl Ester

5. Clorius

6. Niobe Oil

7. Methyl Benzenecarboxylate

8. Oil Of Niobe

9. Essence Of Niobe

10. Oniobe Oil

11. Fema No. 2683

12. Oxidate Le

13. Nsc 9394

14. Methylester Kyseliny Benzoove

15. Methyl Ester Of Benzoic Acid

16. Chebi:72775

17. 6618k1vj9t

18. Nsc-9394

19. Dsstox_cid_5572

20. Dsstox_rid_77836

21. Dsstox_gsid_25572

22. Methyl Benzoate (natural)

23. Cas-93-58-3

24. Ccris 5851

25. Hsdb 5283

26. Einecs 202-259-7

27. Mfcd00008421

28. Un2938

29. Methylester Kyseliny Benzoove [czech]

30. Unii-6618k1vj9t

31. Ai3-00525

32. Benzoic Acid Methyl

33. Methyloxycarbonylbenzene

34. Clorius-

35. Benzoic Acid Methylester

36. Methyl Benzoate, 99%

37. Benzoic Acid-methyl Ester

38. Wln: 1ovr

39. Ec 202-259-7

40. Schembl7200

41. Methyl Benzoate [mi]

42. Mls001050185

43. Chembl16435

44. Methyl Benzoate [fcc]

45. Methyl Benzoate [fhfi]

46. Methyl Benzoate [hsdb]

47. Methyl Benzoate [inci]

48. Schembl4790973

49. Dtxsid5025572

50. Schembl10330498

51. Nsc9394

52. Methyl Benzoate, >=99% (gc)

53. Zinc156868

54. Act10969

55. Methyl Benzoate, Analytical Standard

56. Tox21_201832

57. Tox21_303198

58. Bbl010502

59. Stk021498

60. Akos000120640

61. Methyl Benzoate, >=98%, Fcc, Fg

62. At34734

63. Un 2938

64. Methyl Benzoate, For Synthesis, 98.0%

65. Ncgc00091665-01

66. Ncgc00091665-02

67. Ncgc00256939-01

68. Ncgc00259381-01

69. Bp-31073

70. Smr001216584

71. Vs-02533

72. B0074

73. Ft-0622713

74. Methyl Benzoate, Natural, >=98%, Fcc, Fg

75. C20645

76. A844641

77. Q417328

78. J-522592

79. Methyl Benzoate [un2938] [keep Away From Food]

80. Z19825577

81. F0001-2239

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 136.15 g/mol
Molecular Formula C8H8O2
XLogP32.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass136.052429494 g/mol
Monoisotopic Mass136.052429494 g/mol
Topological Polar Surface Area26.3 Ų
Heavy Atom Count10
Formal Charge0
Complexity114
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1
4 Pharmacology and Biochemistry
4.1 Absorption, Distribution and Excretion

The penetration of methyl benzoate ... through excised guinea pig dorsal skin was measured using diffusion cells. The permeability coefficient (Kp) /was/ 20.3 +/- 5.8x10-2 cm/hr ... indicating significant steady-state dermal penetration. Permeability was increased by removal of the stratum corneum by tape stripping and delipidization using a chloroform-methanol mixture. Penetration was decreased by the addition of 1-methanol plus 15% ethanol.

Cosmetic Ingredient Review Expert Panel; International Journal of Toxicology: 31(suppl. 3): 342S-372S (2012). Available from, as of July 2, 2015: https://www.ctfa.org/ingredients


Methyl benzoate has a low order of skin absorbability.

Bingham, E.; Cohrssen, B.; Powell, C.H.; Patty's Toxicology Volumes 1-9 5th ed. John Wiley & Sons. New York, N.Y. (2001)., p. V6 643


Methyl benzoate was slow to penetrate the skin of rats.

Opdyke, D.L.J. (ed.). Monographs on Fragrance Raw Materials. New York: Pergamon Press, 1979., p. 537


4.2 Metabolism/Metabolites

/Methyl benzoate/ is metabolized to benzoic acid in rabbits.

Bingham, E.; Cohrssen, B.; Powell, C.H.; Patty's Toxicology Volumes 1-9 5th ed. John Wiley & Sons. New York, N.Y. (2001)., p. V6 643


API Reference Price

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02-Jan-2021
13-Nov-2024
KGS
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Average Price (USD/KGS)

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Quantity (KGS) & Unit rate (USD/KGS) over time

API Imports and Exports

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ABOUT THIS PAGE

Methyl Benzoate Manufacturers

A Methyl Benzoate manufacturer is defined as any person or entity involved in the manufacture, preparation, processing, compounding or propagation of Methyl Benzoate, including repackagers and relabelers. The FDA regulates Methyl Benzoate manufacturers to ensure that their products comply with relevant laws and regulations and are safe and effective to use. Methyl Benzoate API Manufacturers are required to adhere to Good Manufacturing Practices (GMP) to ensure that their products are consistently manufactured to meet established quality criteria.

click here to find a list of Methyl Benzoate manufacturers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PhamaCompass.

Methyl Benzoate Suppliers

A Methyl Benzoate supplier is an individual or a company that provides Methyl Benzoate active pharmaceutical ingredient (API) or Methyl Benzoate finished formulations upon request. The Methyl Benzoate suppliers may include Methyl Benzoate API manufacturers, exporters, distributors and traders.

click here to find a list of Methyl Benzoate suppliers with USDMF, JDMF, KDMF, CEP, GMP, COA and API Price related information on PharmaCompass.

Methyl Benzoate GMP

Methyl Benzoate Active pharmaceutical ingredient (API) is produced in GMP-certified manufacturing facility.

GMP stands for Good Manufacturing Practices, which is a system used in the pharmaceutical industry to make sure that goods are regularly produced and monitored in accordance with quality standards. The FDA’s current Good Manufacturing Practices requirements are referred to as cGMP or current GMP which indicates that the company follows the most recent GMP specifications. The World Health Organization (WHO) has its own set of GMP guidelines, called the WHO GMP. Different countries can also set their own guidelines for GMP like China (Chinese GMP) or the EU (EU GMP).

PharmaCompass offers a list of Methyl Benzoate GMP manufacturers, exporters & distributors, which can be sorted by USDMF, JDMF, KDMF, CEP (COS), WC, API price, and more, enabling you to easily find the right Methyl Benzoate GMP manufacturer or Methyl Benzoate GMP API supplier for your needs.

Methyl Benzoate CoA

A Methyl Benzoate CoA (Certificate of Analysis) is a formal document that attests to Methyl Benzoate's compliance with Methyl Benzoate specifications and serves as a tool for batch-level quality control.

Methyl Benzoate CoA mostly includes findings from lab analyses of a specific batch. For each Methyl Benzoate CoA document that a company creates, the USFDA specifies specific requirements, such as supplier information, material identification, transportation data, evidence of conformity and signature data.

Methyl Benzoate may be tested according to a variety of international standards, such as European Pharmacopoeia (Methyl Benzoate EP), Methyl Benzoate JP (Japanese Pharmacopeia) and the US Pharmacopoeia (Methyl Benzoate USP).

Inform the supplier about your product requirements, specifying if you need a product with particular monograph like EP (Ph. Eur.), USP, JP, BP, or any other quality. In addition, clarify whether you need hydrochloride (HCl), anhydricum, base, micronisatum or a specific level of purity. To find reputable suppliers, utilize the filters and select those certified by GMP, FDA, or any other certification as per your requirement.
For your convenience, we have listed synonyms and CAS numbers to help you find the best supplier. The use of synonyms and CAS numbers can be helpful in identifying potential suppliers, but it is crucial to note that they might not always indicate the exact same product. It is important to confirm the product details with the supplier before making a purchase to ensure that it meets your requirements.
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