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Heterocyclic building blocks

Isoidide dinitrate

Also known as 1,4:3,6-Dianhydro-2,5-di-O-nitro-L-iditol, QSPL 034, (3S,3aS,6S,6aS)-6-(nitrooxy)-hexahydrofuro[3,2-b]furan-3-yl nitrate

CAS 575-86-0Formula C6H8N2O8Molar mass 236.14 g/mol
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Isoidide dinitrate chemical structure, C6H8N2O8, CAS 575-86-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
575-86-0
Formula
C6H8N2O8
Molar mass
236.14 g/mol
HS code
293299
Category
Heterocyclic building blocks

What is Isoidide dinitrate?

Plain description, key identifiers and synonyms

Isoidide dinitrate is a chemical substance with the molecular formula C6H8N2O8 and a molar mass of 236.14 g/mol. Its CAS registry number is 575-86-0. The IUPAC name is [(3S,3aS,6S,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] nitrate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[(3S,3aS,6S,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] nitrate
CAS number
575-86-0Other or deprecated CAS: 38777-20-7
Molecular formula
C6H8N2O8
InChIKey
MOYKHGMNXAOIAT-UNTFVMJOSA-N
InChI
InChI=1S/C6H8N2O8/c9-7(10)15-3-1-13-6-4(16-8(11)12)2-14-5(3)6/h3-6H,1-2H2/t3-,4-,5+,6+/m0/s1
Canonical SMILES
O=[N+]([O-])OC1COC2C(O[N+](=O)[O-])COC12
Isomeric SMILES
C1[C@@H]([C@@H]2[C@H](O1)[C@H](CO2)O[N+](=O)[O-])O[N+](=O)[O-]

Synonyms

  • 1,4:3,6-Dianhydro-2,5-di-O-nitro-L-iditol
  • QSPL 034
  • (3S,3aS,6S,6aS)-6-(nitrooxy)-hexahydrofuro[3,2-b]furan-3-yl nitrate
  • L-Iditol, 1,4:3,6-dianhydro-, 2,5-dinitrate
  • (3S,3aS,6S,6aS)-hexahydrofuro[3,2-b]furan-3,6-diyl dinitrate

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
236.14 g/molcalc.
Exact mass
236.0281 Dacalc.
LogP (octanol/water)
-1.06calc.
Topological polar surface area
123.2 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
4calc.
Heavy atoms
16calc.
Rings
2calc.
Aromatic rings
0calc.
Fraction sp3 carbons
1calc.
Formal charge
0calc.
Stereocentres
4calc.
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, C1CC2OCCC2O1

C1CC2OCCC2O1

2 rings, 8 atoms, the 1,4:3,6-Dianhydro-2,5-dideoxyhexitol ring system.

149 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.

Isoidide dinitrate suppliers

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Isoidide dinitrate 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 Isoidide dinitrate is traded under.

HS 2932.99Indicative HS code

Heterocyclic compounds with oxygen hetero-atom(s) only, other

World exports in 2024
$3.81B
+10.3% vs 2023, imports $7.05B
2019 to 2024
Top exporters
  1. China28.9%
  2. Switzerland * partner reported12.7%
  3. Germany7.8%
Top importers
  1. United States49.7%
  2. China11.9%
  3. India * partner reported3.3%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

Quick answers about Isoidide dinitrate, based on the data on this page

What is Isoidide dinitrate?

Isoidide dinitrate is a chemical substance with the molecular formula C6H8N2O8 and a molar mass of 236.14 g/mol. Its CAS registry number is 575-86-0. The IUPAC name is [(3S,3aS,6S,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] nitrate.

What is the CAS number of Isoidide dinitrate?

The CAS registry number of Isoidide dinitrate is 575-86-0. Other or deprecated CAS numbers: 38777-20-7.

What is the molecular formula and weight of Isoidide dinitrate?

The molecular formula of Isoidide dinitrate is C6H8N2O8 and its molar mass is 236.14 g/mol.

What is Isoidide dinitrate used for?

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

Is Isoidide dinitrate hazardous?

No GHS hazard classification for Isoidide dinitrate 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 Isoidide dinitrate?

Isoidide dinitrate is usually classified under HS code 293299 (Heterocyclic compounds with oxygen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Isoidide dinitrate?

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

What is the price of Isoidide dinitrate?

Suppliers quote Isoidide dinitrate 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 Isoidide dinitrate

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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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