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Amino acids and derivatives

Arogenic acid

Also known as Arogenate, 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid, 1-carboxy-4-hydroxy-2,5-cyclohexadien-1-alanine

CAS 87726-53-2Formula C10H13NO5Molar mass 227.22 g/mol
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Arogenic acid chemical structure, C10H13NO5, CAS 87726-53-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
87726-53-2
Formula
C10H13NO5
Molar mass
227.22 g/mol
HS code
292250
Category
Amino acids and derivatives

What is Arogenic acid?

Plain description, key identifiers and synonyms

Arogenic acid is a non-proteinogenic alpha-amino acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid
CAS number
87726-53-2
Molecular formula
C10H13NO5
InChIKey
MIEILDYWGANZNH-UHFFFAOYSA-N
InChI
InChI=1S/C10H13NO5/c11-7(8(13)14)5-10(9(15)16)3-1-6(12)2-4-10/h1-4,6-7,12H,5,11H2,(H,13,14)(H,15,16)
SMILES (canonical and isomeric)
C1=CC(C=CC1O)(CC(C(=O)O)N)C(=O)O

Synonyms

  • Arogenate
  • 1-(2-amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-diene-1-carboxylic acid
  • 1-carboxy-4-hydroxy-2,5-cyclohexadien-1-alanine
  • 1-(2-Amino-2-carboxyethyl)-4-hydroxycyclohexa-2,5-dienecarboxylic acid

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
227.22 g/molcalc.
Exact mass
227.0794 Dacalc.
LogP (octanol/water)
-0.65calc.
Topological polar surface area
120.9 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
4calc.
Heavy atoms
16calc.
Rings
1calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.4calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, C1=CCC=CC1

C1=CCC=CC1

1 ring, 6 atoms, the 1,4-Cyclohexadiene ring system.

351 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Arogenic acid suppliers

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Arogenic acid price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Applications are not documented for this substance yet. Suppliers often describe uses on their product pages, linked in the suppliers list above.

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Arogenic acid is traded under.

HS 2922.50Indicative HS code

Amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function

World exports in 2024
$3.29B
−5.9% vs 2023, imports $3.19B
2019 to 2024
Top exporters
  1. China39.2%
  2. United Kingdom27.1%
  3. India * partner reported4.8%
Top importers
  1. United States20.7%
  2. Germany7.6%
  3. Italy6.6%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Arogenic acid is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Arogenic acid, based on the data on this page

What is Arogenic acid?

Arogenic acid is a non-proteinogenic alpha-amino acid.

What is the CAS number of Arogenic acid?

The CAS registry number of Arogenic acid is 87726-53-2.

What is the molecular formula and weight of Arogenic acid?

The molecular formula of Arogenic acid is C10H13NO5 and its molar mass is 227.22 g/mol.

Is Arogenic acid hazardous?

No GHS hazard classification for Arogenic acid is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Arogenic acid?

Arogenic acid is usually classified under HS code 292250 (Amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Arogenic acid?

Post a free request on CompoundList and suppliers of Arogenic acid will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Arogenic acid?

Suppliers quote Arogenic acid on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Arogenic acid

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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