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Screening compounds

Hexanitrobiphenyldiamine

CAS 28088-73-5Formula C12H6N8O12Molar mass 454.22 g/molEC 248-830-4
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Hexanitrobiphenyldiamine chemical structure, C12H6N8O12, CAS 28088-73-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
28088-73-5
Formula
C12H6N8O12
Molar mass
454.22 g/mol
EC number
248-830-4
HS code
292159
Category
Screening compounds

What is Hexanitrobiphenyldiamine?

Plain description, key identifiers and synonyms

Hexanitrobiphenyldiamine is a chemical substance with the molecular formula C12H6N8O12 and a molar mass of 454.22 g/mol. Its CAS registry number is 28088-73-5. The IUPAC name is 6-(2-amino-3,4,5-trinitrophenyl)-2,3,4-trinitroaniline.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
6-(2-amino-3,4,5-trinitrophenyl)-2,3,4-trinitroaniline
CAS number
28088-73-5
EC number
248-830-4
Molecular formula
C12H6N8O12
InChIKey
UKFLKXPAZWYTJP-UHFFFAOYSA-N
InChI
InChI=1S/C12H6N8O12/c13-7-3(1-5(15(21)22)9(17(25)26)11(7)19(29)30)4-2-6(16(23)24)10(18(27)28)12(8(4)14)20(31)32/h1-2H,13-14H2
SMILES (canonical and isomeric)
C1=C(C(=C(C(=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N)C2=CC(=C(C(=C2N)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[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
454.22 g/molcalc.
Exact mass
454.0105 Dacalc.
LogP (octanol/water)
1.97calc.
Topological polar surface area
310.9 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
14calc.
Rotatable bonds
7calc.
Heavy atoms
32calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Passes (1 violation)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, c1ccc(-c2ccccc2)cc1

c1ccc(-c2ccccc2)cc1

2 rings, 12 atoms, the Biphenyl ring system.

32,228 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.

Hexanitrobiphenyldiamine suppliers

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Hexanitrobiphenyldiamine 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 Hexanitrobiphenyldiamine is traded under.

HS 2921.59Indicative HS code

Aromatic polyamines and their derivatives, salts thereof, other

World exports in 2024
$510M
−0.4% vs 2023, imports $488M
2019 to 2024
Top exporters
  1. China26.6%
  2. Japan16.6%
  3. India * partner reported12.4%
Top importers
  1. United States17.9%
  2. Germany11.6%
  3. South Korea7.4%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Hexanitrobiphenyldiamine?

Hexanitrobiphenyldiamine is a chemical substance with the molecular formula C12H6N8O12 and a molar mass of 454.22 g/mol. Its CAS registry number is 28088-73-5. The IUPAC name is 6-(2-amino-3,4,5-trinitrophenyl)-2,3,4-trinitroaniline.

What is the CAS number of Hexanitrobiphenyldiamine?

The CAS registry number of Hexanitrobiphenyldiamine is 28088-73-5.

What is the molecular formula and weight of Hexanitrobiphenyldiamine?

The molecular formula of Hexanitrobiphenyldiamine is C12H6N8O12 and its molar mass is 454.22 g/mol.

What is Hexanitrobiphenyldiamine used for?

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

Is Hexanitrobiphenyldiamine hazardous?

No GHS hazard classification for Hexanitrobiphenyldiamine 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 Hexanitrobiphenyldiamine?

Hexanitrobiphenyldiamine is usually classified under HS code 292159 (Aromatic polyamines and their derivatives, salts thereof, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Hexanitrobiphenyldiamine?

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What is the price of Hexanitrobiphenyldiamine?

Suppliers quote Hexanitrobiphenyldiamine 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 Hexanitrobiphenyldiamine

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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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