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Aromatic building blocks

Nitroacephenanthrylene

Also known as 1-Nitroacephenanthrylene

CAS 114790-09-9Formula C16H9NO2Molar mass 247.25 g/mol
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Nitroacephenanthrylene chemical structure, C16H9NO2, CAS 114790-09-9
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
114790-09-9
Formula
C16H9NO2
Molar mass
247.25 g/mol
HS code
290420
Category
Aromatic building blocks

What is Nitroacephenanthrylene?

Plain description, key identifiers and synonyms

Nitroacephenanthrylene is a chemical substance with the molecular formula C16H9NO2 and a molar mass of 247.25 g/mol. Its CAS registry number is 114790-09-9. The IUPAC name is 1-nitroacephenanthrylene.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-nitroacephenanthrylene
CAS number
114790-09-9 CAS number cross-checked
Molecular formula
C16H9NO2
InChIKey
DNSJGYSXEAUJMS-UHFFFAOYSA-N
InChI
InChI=1S/C16H9NO2/c18-17(19)14-8-7-10-5-6-12-9-11-3-1-2-4-13(11)16(14)15(10)12/h1-9H
SMILES (canonical and isomeric)
C1=CC=C2C(=C1)C=C3C=CC4=C3C2=C(C=C4)[N+](=O)[O-]

Synonyms

  • 1-Nitroacephenanthrylene

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
247.25 g/molcalc.
Exact mass
247.0633 Dacalc.
LogP (octanol/water)
4.39calc.
Topological polar surface area
43.14 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
2calc.
Rotatable bonds
1calc.
Heavy atoms
19calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0calc.
Formal charge
0calc.
Stereocentres
0calc.
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=Cc2cc3ccccc3c3cccc1c23

C1=Cc2cc3ccccc3c3cccc1c23

4 rings, 16 atoms, the Acephenanthrylene ring system.

6 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.

Nitroacephenanthrylene suppliers

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Nitroacephenanthrylene 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 Nitroacephenanthrylene is traded under.

HS 2904.20Indicative HS code

Derivatives containing only nitro or only nitroso groups

World exports in 2024
$440M
+46.4% vs 2023, imports $463M
2019 to 2024
Top exporters
  1. Germany27.6%
  2. Poland17.1%
  3. Portugal16.0%
Top importers
  1. Belgium34.0%
  2. United States11.0%
  3. Germany9.1%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Nitroacephenanthrylene?

Nitroacephenanthrylene is a chemical substance with the molecular formula C16H9NO2 and a molar mass of 247.25 g/mol. Its CAS registry number is 114790-09-9. The IUPAC name is 1-nitroacephenanthrylene.

What is the CAS number of Nitroacephenanthrylene?

The CAS registry number of Nitroacephenanthrylene is 114790-09-9.

What is the molecular formula and weight of Nitroacephenanthrylene?

The molecular formula of Nitroacephenanthrylene is C16H9NO2 and its molar mass is 247.25 g/mol.

What is Nitroacephenanthrylene used for?

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

Is Nitroacephenanthrylene hazardous?

No GHS hazard classification for Nitroacephenanthrylene 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 Nitroacephenanthrylene?

Nitroacephenanthrylene is usually classified under HS code 290420 (Derivatives containing only nitro or only nitroso groups). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Nitroacephenanthrylene?

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

What is the price of Nitroacephenanthrylene?

Suppliers quote Nitroacephenanthrylene 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 Nitroacephenanthrylene

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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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