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Aliphatic and alicyclic building blocks

Mirogabalin

Also known as 2-((1R,5S,6S)-6-(aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl)acetic acid, 2-[(1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo[3.2.0]hept-3-enyl]acetic acid, Mirogabalina

CAS 1138245-13-2Formula C12H19NO2Molar mass 209.29 g/molEC 195-505-7
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Mirogabalin chemical structure, C12H19NO2, CAS 1138245-13-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1138245-13-2
Formula
C12H19NO2
Molar mass
209.29 g/mol
EC number
195-505-7
HS code
292249
Category
Aliphatic and alicyclic building blocks

What is Mirogabalin?

Plain description, key identifiers and synonyms

Mirogabalin is a chemical substance with the molecular formula C12H19NO2 and a molar mass of 209.29 g/mol. Its CAS registry number is 1138245-13-2. The IUPAC name is 2-[(1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo[3.2.0]hept-3-enyl]acetic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
2-[(1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo[3.2.0]hept-3-enyl]acetic acid
CAS number
1138245-13-2 CAS number cross-checkedOther or deprecated CAS: 1138244-97-9
EC number
195-505-7
Molecular formula
C12H19NO2
UNII
S7LK2KDM5U
MDL number
MFCD28411425
InChIKey
FTBQORVNHOIASH-CKYFFXLPSA-N
InChI
InChI=1S/C12H19NO2/c1-2-8-3-9-5-12(7-13,6-11(14)15)10(9)4-8/h4,9-10H,2-3,5-7,13H2,1H3,(H,14,15)/t9-,10-,12-/m1/s1
Canonical SMILES
CCC1=CC2C(C1)CC2(CN)CC(=O)O
Isomeric SMILES
CCC1=C[C@@H]2[C@H](C1)C[C@@]2(CC(=O)O)CN

Synonyms

  • 2-((1R,5S,6S)-6-(aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl)acetic acid
  • 2-[(1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo[3.2.0]hept-3-enyl]acetic acid
  • Mirogabalina
  • Mirogabaline
  • ((1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo(3.2.0)hept-3-en-6-yl)acetic acid
  • Bicyclo(3.2.0)hept-3-ene-6-acetic acid, 6-(aminomethyl)-3-ethyl-, (1R,5S,6S)-
  • 2-[(1R,5S,6S)-6-(aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid
  • [(1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid
  • mirogabalinum
  • 2-((1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo(3.2.0)hept-3-enyl)acetic acid
  • 2-((1R,5S,6S)-6-(aminomethyl)-3-ethylbicyclo(3.2.0)hept-3-en-6-yl)acetic acid
  • Bicyclo[3.2.0]hept-3-ene-6-acetic acid, 6-(aminomethyl)-3-ethyl-, (1R,5S,6S)-
  • Mirogabalin (DS-5565)
  • (1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-ene-6-acetic Acid
  • Aminomethyl)-3-ethyl-bicyclo(3.2.0)hept-3-ene-6-acetic acid
  • DS 5565
  • Bicycl
  • [3H]mirogabalin
  • mirogabalin-besylate
  • Mirogabalin (Standard)
  • Mirogabalin (USAN/INN)
  • [(1r,5s,6s)-6-aminomethyl-3-ethylbicyclo[3.2.0]hept-3-en-6-yl]acetic acid
  • Dimethyl sulfoxide-d6, '100%', 99.96 atom % D, contains 1 % (v/v) TMS
  • rel-2-((1R,5S,6S)-6-(Aminomethyl)-3-ethylbicyclo[3.2.0]hept-3-en-6-yl)acetic 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
209.29 g/molcalc.
Exact mass
209.1416 Dacalc.
LogP (octanol/water)
1.78calc.
Topological polar surface area
63.32 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
4calc.
Heavy atoms
15calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
0.75calc.
Formal charge
0calc.
Stereocentres
3calc.
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=CC2CCC2C1

C1=CC2CCC2C1

2 rings, 7 atoms, the Bicyclo(3.2.0)hept-2-ene ring system.

47 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.

Mirogabalin suppliers

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All 20 suppliers
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Where suppliers are based

20 suppliers in 7 countries

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Mirogabalin price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

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 Mirogabalin is traded under.

HS 2922.49Indicative HS code

Amino-acids, other than those containing more than one kind of oxygen function, and…

World exports in 2024
$3.88B
−11.5% vs 2023, imports $3.87B
2019 to 2024
Top exporters
  1. China38.7%
  2. India * partner reported8.3%
  3. Germany8.1%
Top importers
  1. United States13.4%
  2. Germany11.1%
  3. Japan6.6%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Mirogabalin, based on the data on this page

What is Mirogabalin?

Mirogabalin is a chemical substance with the molecular formula C12H19NO2 and a molar mass of 209.29 g/mol. Its CAS registry number is 1138245-13-2. The IUPAC name is 2-[(1R,5S,6S)-6-(aminomethyl)-3-ethyl-6-bicyclo[3.2.0]hept-3-enyl]acetic acid.

What is the CAS number of Mirogabalin?

The CAS registry number of Mirogabalin is 1138245-13-2. Other or deprecated CAS numbers: 1138244-97-9.

What is the molecular formula and weight of Mirogabalin?

The molecular formula of Mirogabalin is C12H19NO2 and its molar mass is 209.29 g/mol.

What is Mirogabalin used for?

Known uses and roles of Mirogabalin include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Mirogabalin hazardous?

No GHS hazard classification for Mirogabalin 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 Mirogabalin?

Mirogabalin is usually classified under HS code 292249 (Amino-acids, other than those containing more than one kind of oxygen function, and…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Mirogabalin?

CompoundList lists 20 suppliers of Mirogabalin in China, Bangladesh, Canada, France and 3 more. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

Where can I buy Mirogabalin in India?

1 supplier in India list Mirogabalin on CompoundList. Filter the suppliers list by country and send a request to compare prices, grades and delivery times.

What is the price of Mirogabalin?

Suppliers quote Mirogabalin 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

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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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