Structure

3-O-Ethyl-L-Ascorbic Acid

CAS
86404-04-8
Catalog Number
ACM86404048
Category
Material of Cosmetics
Molecular Weight
204.18
Molecular Formula
C8H12O6

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Specification

Synonyms
3-O-Ethyl Ascorbyl Ether;3-O-Ethyl-L-ascorbic Acid;ETHYL ASCORBIC ACID;(5r)-5-[(1s)-1,2-dihydroxyethyl]-4-ethoxy-3-hydroxy-5h-furan-2-one;3-o-ethyl-l-ascorbic acid;3-O-ETHYLASCORBICACID;(5R,1'S)-5-(1,2-Dihydroxy-ethyl)-4-ethoxy-3-hydroxy-5H-furan-2-one;(R)-5-((S)-1,2-dihydroxyethyl)-4-ethoxy-3-hydroxyfuran-2(5H)-one
Boiling Point
551.5 °C at 760 mmHg
Melting Point
111-116 °C
Solubility
Easily dissolve in water
Appearance
White powder
Application
Cosmetic Raw Materials
Assay
99.0-101.0%
EC Number
617-849-3
Grade
Pharmaceutical Grade
pH
3.0-6.0
Storage Conditions
Cool Dry Place
What is the molecular formula of 3-O-Ethyl-L-ascorbic acid according to the reference?

The molecular formula of 3-O-Ethyl-L-ascorbic acid is C8H12O6.

What is the molecular weight of 3-O-Ethyl-L-ascorbic acid?

The molecular weight of 3-O-Ethyl-L-ascorbic acid is 204.18 g/mol.

When was 3-O-Ethyl-L-ascorbic acid created in the database?

3-O-Ethyl-L-ascorbic acid was created in the database on August 8, 2005.

What is the IUPAC name of 3-O-Ethyl-L-ascorbic acid according to the reference?

The IUPAC name of 3-O-Ethyl-L-ascorbic acid is (2R)-2-[(1S)-1,2-dihydroxyethyl]-3-ethoxy-4-hydroxy-2H-furan-5-one.

What is the InChIKey of 3-O-Ethyl-L-ascorbic acid?

The InChIKey of 3-O-Ethyl-L-ascorbic acid is ZGSCRDSBTNQPMS-UJURSFKZSA-N.

What are some synonyms for 3-O-Ethyl-L-ascorbic acid?

Some synonyms for 3-O-Ethyl-L-ascorbic acid include 3-o-ethyl ascorbic acid and 3-O-Ethylascorbic acid.

What is the Canonical SMILES representation of 3-O-Ethyl-L-ascorbic acid?

The Canonical SMILES representation of 3-O-Ethyl-L-ascorbic acid is CCOC1=C(C(=O)OC1C(CO)O)O.

How many hydrogen bond donor counts does 3-O-Ethyl-L-ascorbic acid have?

3-O-Ethyl-L-ascorbic acid has 3 hydrogen bond donor counts.

What is the topological polar surface area of 3-O-Ethyl-L-ascorbic acid?

The topological polar surface area of 3-O-Ethyl-L-ascorbic acid is 96.2 Å2.

What is the formal charge of 3-O-Ethyl-L-ascorbic acid?

The formal charge of 3-O-Ethyl-L-ascorbic acid is 0.

Upstream Synthesis Route 1

  • 86404-03-7
  • 86404-04-8

Reference: [1] Journal of Medicinal Chemistry, 1992, vol. 35, # 9, p. 1618 - 1623

Upstream Synthesis Route 2

  • 74-96-4
  • 146-75-8
  • 86404-04-8

Reference: [1] Bioscience, Biotechnology and Biochemistry, 2014, vol. 78, # 12, p. 1984 - 1987

Upstream Synthesis Route 3

  • 74-96-4
  • 50-81-7
  • 86404-04-8

Reference: [1] Patent: WO2009/14343, 2009, A2, . Location in patent: Page/Page column 21; 23

Upstream Synthesis Route 4

  • 62-50-0
  • 50-81-7
  • 86404-04-8

Reference: [1]Heterocycles,2005,vol. 66,p. 579 - 582

Upstream Synthesis Route 5

  • 64-17-5
  • 50-81-7
  • 86404-04-8

Reference: [1]Current Patent Assignee: SHANGHAI JIAKAI BIOLOGICAL TECH - CN112778246, 2021, A
Location in patent: Paragraph 0021-0038

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