CompoundList
Sign in
Amines and amides

Triple dye

CAS 39389-84-9Formula C65H76ClN8O8S2-Molar mass 1,196.96 g/mol
Get quotes Safety data
Triple dye chemical structure, C65H76ClN8O8S2-, CAS 39389-84-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
39389-84-9
Formula
C65H76ClN8O8S2-
Molar mass
1,196.96 g/mol
HS code
292149
Category
Amines and amides

What is Triple dye?

Plain description, key identifiers and synonyms

Triple dye is a chemical substance with the molecular formula C65H76ClN8O8S2- and a molar mass of 1,196.96 g/mol. Its CAS registry number is 39389-84-9. The IUPAC name is acridine-3,6-diamine, [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium, [4-[[4-(diethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium, sulfuric acid, chloride, sulfate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
acridine-3,6-diamine, [4-[bis[4-(dimethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium, [4-[[4-(diethylamino)phenyl]-phenylmethylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium, sulfuric acid, chloride, sulfate
CAS number
39389-84-9
Molecular formula
C65H76ClN8O8S2-
InChIKey
FIHXJYZPRIXNDV-UHFFFAOYSA-K
InChI
InChI=1S/C27H33N2.C25H30N3.C13H11N3.ClH.2H2O4S/c1-5-28(6-2)25-18-14-23(15-19-25)27(22-12-10-9-11-13-22)24-16-20-26(21-17-24)29(7-3)8-4;1-26(2)22-13-7-19(8-14-22)25(20-9-15-23(16-10-20)27(3)4)21-11-17-24(18-12-21)28(5)6;14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10;;2*1-5(2,3)4/h9-21H,5-8H2,1-4H3;7-18H,1-6H3;1-7H,14-15H2;1H;2*(H2,1,2,3,4)/q2*+1;;;;/p-3
SMILES (canonical and isomeric)
CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=CC=C3.CN(C)C1=CC=C(C=C1)C(=C2C=CC(=[N+](C)C)C=C2)C3=CC=C(C=C3)N(C)C.C1=CC(=CC2=NC3=C(C=CC(=C3)N)C=C21)N.OS(=O)(=O)O.[O-]S(=O)(=O)[O-].[Cl-]

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
1,196.96 g/molcalc.
Exact mass
1,195.4922 Dacalc.
LogP (octanol/water)
7.98calc.
Topological polar surface area
235.5 Ųcalc.
Hydrogen bond donors
4calc.
Hydrogen bond acceptors
12calc.
Rotatable bonds
11calc.
Heavy atoms
84calc.
Rings
9calc.
Aromatic rings
7calc.
Fraction sp3 carbons
0.22calc.
Formal charge
-1calc.
Stereocentres
0calc.
Components
6calc.
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, [N+]=C1C=CC(=C(c2ccccc2)c2ccccc2)C=C1

[N+]=C1C=CC(=C(c2ccccc2)c2ccccc2)C=C1

3 rings, 20 atoms.

122 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.

Triple dye suppliers

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

No supplier listings yet

Post one free request and suppliers who make or trade Triple dye can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Triple dye 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.

Get latest price

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 Triple dye is traded under.

HS 2921.49Indicative HS code

Aromatic monoamines and their derivatives, salts thereof, other

World exports in 2024
$1.14B
+5.6% vs 2023, imports $1.06B
2019 to 2024
Top exporters
  1. Germany23.3%
  2. China19.4%
  3. Singapore14.6%
Top importers
  1. Belgium15.9%
  2. South Korea15.0%
  3. Germany12.8%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

Quick answers about Triple dye, based on the data on this page

What is Triple dye?

Triple dye is a chemical substance with the molecular formula C65H76ClN8O8S2- and a molar mass of 1,196.96 g/mol. Its CAS registry number is 39389-84-9.

What is the CAS number of Triple dye?

The CAS registry number of Triple dye is 39389-84-9.

What is the molecular formula and weight of Triple dye?

The molecular formula of Triple dye is C65H76ClN8O8S2- and its molar mass is 1,196.96 g/mol.

Is Triple dye hazardous?

No GHS hazard classification for Triple dye 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 Triple dye?

Triple dye is usually classified under HS code 292149 (Aromatic monoamines and their derivatives, salts thereof, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Triple dye?

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

What is the price of Triple dye?

Suppliers quote Triple dye 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 Triple dye

Get quotes for Triple dye

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Triple dye
Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
Embed this structure on your websiteShow code

Paste this code into your page to show the 2D structure of Triple dye with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.

<iframe src="https://www.compoundlist.com/embed/structure/triple-dye-39389-84-9" title="Triple dye structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>
Preview the embed

Explore more in Amines and amides or HS code 292149

Price on request
Free quotes, contact stays private
Get quotes