CompoundList
Sign in
Aromatic building blocks

Nitrostyrene

Also known as Styrocide, Nitrostyrene (pesticide), 4-(2-Nitro-1-propenyl)phenyl thiocyanate

CAS 950-00-5Formula C10H8N2O2SMolar mass 220.25 g/mol
Get quotes Safety data
Nitrostyrene chemical structure, C10H8N2O2S, CAS 950-00-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
950-00-5
Formula
C10H8N2O2S
Molar mass
220.25 g/mol
HS code
293090
Category
Aromatic building blocks

What is Nitrostyrene?

Plain description, key identifiers and synonyms

Nitrostyrene is a chemical substance with the molecular formula C10H8N2O2S and a molar mass of 220.25 g/mol. Its CAS registry number is 950-00-5. The IUPAC name is [4-[(Z)-2-nitroprop-1-enyl]phenyl] thiocyanate.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
[4-[(Z)-2-nitroprop-1-enyl]phenyl] thiocyanate
CAS number
950-00-5
Molecular formula
C10H8N2O2S
InChIKey
UHRMSMOCULMYMJ-VURMDHGXSA-N
InChI
InChI=1S/C10H8N2O2S/c1-8(12(13)14)6-9-2-4-10(5-3-9)15-7-11/h2-6H,1H3/b8-6-
SMILES
C/C(=C/C1=CC=C(C=C1)SC#N)/[N+](=O)[O-]

Synonyms

  • Styrocide
  • Nitrostyrene (pesticide)
  • 4-(2-Nitro-1-propenyl)phenyl thiocyanate
  • Thiocyanic acid, p-(2-nitropropenyl)phenyl ester
  • Thiocyanic acid 4-(2-nitro-1-propenyl)phenyl ester

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
220.25 g/molcalc.
Exact mass
220.0306 Dacalc.
LogP (octanol/water)
2.9calc.
Topological polar surface area
66.93 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
3calc.
Heavy atoms
15calc.
Rings
1calc.
Aromatic rings
1calc.
Fraction sp3 carbons
0.1calc.
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, 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.

Nitrostyrene 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 Nitrostyrene can send you quotes. Your contact details stay private until you accept a quote.

Request quotesSell this chemical

Nitrostyrene 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

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 Nitrostyrene is traded under.

HS 2930.90Indicative HS code

Organo-sulphur compounds, other

World exports in 2024
$5.83B
+0.1% vs 2023, imports $5.93B
2019 to 2024
Top exporters
  1. China40.7%
  2. United States10.9%
  3. Japan9.3%
Top importers
  1. United States13.3%
  2. Brazil12.6%
  3. China6.6%
Reported customs values in USD, not prices.Full trade data

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

Frequently asked questions

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

What is Nitrostyrene?

Nitrostyrene is a chemical substance with the molecular formula C10H8N2O2S and a molar mass of 220.25 g/mol. Its CAS registry number is 950-00-5. The IUPAC name is [4-[(Z)-2-nitroprop-1-enyl]phenyl] thiocyanate.

What is the CAS number of Nitrostyrene?

The CAS registry number of Nitrostyrene is 950-00-5.

What is the molecular formula and weight of Nitrostyrene?

The molecular formula of Nitrostyrene is C10H8N2O2S and its molar mass is 220.25 g/mol.

What is Nitrostyrene used for?

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

Is Nitrostyrene hazardous?

No GHS hazard classification for Nitrostyrene 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 Nitrostyrene?

Nitrostyrene is usually classified under HS code 293090 (Organo-sulphur compounds, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Nitrostyrene?

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

What is the price of Nitrostyrene?

Suppliers quote Nitrostyrene 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 Nitrostyrene

Get quotes for Nitrostyrene

Post one free request with your grade, quantity and destination. Matching suppliers send quotes you can compare side by side.
Post a request Sell Nitrostyrene
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 Nitrostyrene 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/nitrostyrene-950-00-5" title="Nitrostyrene 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 Aromatic building blocks or HS code 293090

Price on request
Free quotes, contact stays private
Get quotes