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Amines and amides

ArgTX-93 TFA

CAS 1161025-20-2Formula C36H56F9N9O12Molar mass 977.88 g/mol
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ArgTX-93 TFA chemical structure, C36H56F9N9O12, CAS 1161025-20-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1161025-20-2
Formula
C36H56F9N9O12
Molar mass
977.88 g/mol
HS code
292529
Category
Amines and amides

What is ArgTX-93 TFA?

Plain description, key identifiers and synonyms

ArgTX-93 TFA is a chemical substance with the molecular formula C36H56F9N9O12 and a molar mass of 977.88 g/mol. Its CAS registry number is 1161025-20-2. The IUPAC name is (2S)-N-[9-[3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propylamino]nonyl]-2-[[2-(2,4-dihydroxyphenyl)acetyl]amino]butanediamide, tris(2,2,2-trifluoroacetic acid).

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
(2S)-N-[9-[3-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propylamino]nonyl]-2-[[2-(2,4-dihydroxyphenyl)acetyl]amino]butanediamide, tris(2,2,2-trifluoroacetic acid)
CAS number
1161025-20-2
Molecular formula
C36H56F9N9O12
InChIKey
BCFCAKJJQFWJAI-HFYJLKHYSA-N
InChI
InChI=1S/C30H53N9O6.3C2HF3O2/c31-23(10-8-16-38-30(33)34)28(44)36-17-9-14-35-13-6-4-2-1-3-5-7-15-37-29(45)24(20-26(32)42)39-27(43)18-21-11-12-22(40)19-25(21)41;3*3-2(4,5)1(6)7/h11-12,19,23-24,35,40-41H,1-10,13-18,20,31H2,(H2,32,42)(H,36,44)(H,37,45)(H,39,43)(H4,33,34,38);3*(H,6,7)/t23-,24-;;;/m0.../s1
Canonical SMILES
NC(=O)CC(NC(=O)Cc1ccc(O)cc1O)C(=O)NCCCCCCCCCNCCCNC(=O)C(N)CCCN=C(N)N.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F.O=C(O)C(F)(F)F
Isomeric SMILES
C1=CC(=C(C=C1O)O)CC(=O)N[C@@H](CC(=O)N)C(=O)NCCCCCCCCCNCCCNC(=O)[C@H](CCCN=C(N)N)N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O

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
977.88 g/molcalc.
Exact mass
977.3905 Dacalc.
LogP (octanol/water)
1.22calc.
Topological polar surface area
385.2 Ųcalc.
Hydrogen bond donors
13calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
25calc.
Heavy atoms
66calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.61calc.
Formal charge
0calc.
Stereocentres
2calc.
Components
4calc.
Lipinski rule of five
Fails (3 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, c1ccccc1

c1ccccc1

1 ring, 6 atoms, the Benzene ring system.

485,677 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.

ArgTX-93 TFA suppliers

Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings

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ArgTX-93 TFA 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

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 ArgTX-93 TFA is traded under.

HS 2925.29Indicative HS code

Imines and their derivatives, salts thereof, other

World exports in 2024
$1.8B
+12.4% vs 2023, imports $1.84B
2019 to 2024
Top exporters
  1. China35.9%
  2. France * partner reported15.5%
  3. Germany9.1%
Top importers
  1. United States13.3%
  2. China13.0%
  3. Brazil9.7%

* Partner reported figures, a lower bound.

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

The HS code shown for ArgTX-93 TFA is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about ArgTX-93 TFA, based on the data on this page

What is ArgTX-93 TFA?

ArgTX-93 TFA is a chemical substance with the molecular formula C36H56F9N9O12 and a molar mass of 977.88 g/mol. Its CAS registry number is 1161025-20-2.

What is the CAS number of ArgTX-93 TFA?

The CAS registry number of ArgTX-93 TFA is 1161025-20-2.

What is the molecular formula and weight of ArgTX-93 TFA?

The molecular formula of ArgTX-93 TFA is C36H56F9N9O12 and its molar mass is 977.88 g/mol.

Is ArgTX-93 TFA hazardous?

No GHS hazard classification for ArgTX-93 TFA 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 ArgTX-93 TFA?

ArgTX-93 TFA is usually classified under HS code 292529 (Imines and their derivatives, salts thereof, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy ArgTX-93 TFA?

Post a free request on CompoundList and suppliers of ArgTX-93 TFA will send you quotes. Your contact details stay private until you accept a quote.

What is the price of ArgTX-93 TFA?

Suppliers quote ArgTX-93 TFA 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 ArgTX-93 TFA

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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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