RefChem:573147
Also known as 1,4-Dinitrosopiperazine-d8, N,N'-Dinitrosopiperazine-d8, dinitroso(?H?)piperazine
Key facts
What buyers check first
- CAS number
- 69340-07-4
- Formula
- C4H8N4O2
- Molar mass
- 152.18 g/mol
- EC number
- 976-795-1
- HS code
- 284590
- Category
- Isotope-labelled compounds
What is RefChem:573147?
Plain description, key identifiers and synonyms
RefChem:573147 is a chemical substance with the molecular formula C4H8N4O2 and a molar mass of 152.18 g/mol. Its CAS registry number is 69340-07-4. The IUPAC name is 2,2,3,3,5,5,6,6-octadeuterio-1,4-dinitrosopiperazine.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- 2,2,3,3,5,5,6,6-octadeuterio-1,4-dinitrosopiperazine
- CAS number
- 69340-07-4
- EC number
- 976-795-1
- Molecular formula
- C4H8N4O2
- InChIKey
- WNSYEWGYAFFSSQ-SVYQBANQSA-N
- InChI
- InChI=1S/C4H8N4O2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H2/i1D2,2D2,3D2,4D2
- Canonical SMILES
- O=NN1CCN(N=O)CC1
- Isomeric SMILES
- [2H]C1(C(N(C(C(N1N=O)([2H])[2H])([2H])[2H])N=O)([2H])[2H])[2H]
Synonyms
- 1,4-Dinitrosopiperazine-d8
- N,N'-Dinitrosopiperazine-d8
- dinitroso(?H?)piperazine
- 2,2,3,3,5,5,6,6-octadeuterio-1,4-dinitrosopiperazine
- N,N'-Dinitrosopiperazine-d8, NSC 339-d8, DNP-d8
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 | 152.18 g/molcalc.Computed value |
|---|---|
| Exact mass | 152.1149 Dacalc.Computed value |
| LogP (octanol/water) | -0.03calc.Computed value |
| Topological polar surface area | 65.34 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 4calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 10calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 1calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 0calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H301Toxic if swallowed.
- H315Causes skin irritation.
- H317May cause an allergic skin reaction.
- H318Causes serious eye damage.
- H334May cause allergy or asthma symptoms or breathing difficulties if inhaled.
- H341Suspected of causing genetic defects.
- H350May cause cancer.
Precautionary statements (26)
- P203Obtain, read and follow all safety instructions before use.
- P233Keep container tightly closed.
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P272Contaminated work clothing should not be allowed out of the workplace.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P284In case of inadequate ventilation wear respiratory protection.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P305 + P354 + P338If in eyes: Immediately rinse with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P317Get medical help.
- P318If exposed or concerned, get medical advice.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P332 + P317If skin irritation occurs: Get medical help.
- P333 + P317If skin irritation or rash occurs: Get medical help.
- P342 + P316If experiencing respiratory symptoms: Get emergency medical help immediately.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403Store in a well-ventilated place.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
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RefChem:573147 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
Industries and functions
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 RefChem:573147 is traded under.
Compounds, inorganic or organic, of such isotopes, whether or not chemically defined
- Ireland55.3%
- Hong Kong11.8%
- United States10.7%
- China24.3%
- Ireland21.9%
- South Korea13.3%
The HS code shown for RefChem:573147 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Related chemicals
Parent and salt forms, stereoisomers, similar structures and isomers
Stereoisomers and isotopic forms
Same connectivity, different stereochemistry or isotopes (same InChIKey skeleton)
Similar structures
Nearest neighbours by Morgan fingerprint Tanimoto similarity
Same formula isomers
Different compounds that share this molecular formula
Frequently asked questions
Quick answers about RefChem:573147, based on the data on this page
Is RefChem:573147 hazardous?
Guides for buyers
Practical guides that help when you source, ship or handle RefChem:573147
- Article, QualityWhat a certificate of analysis should containThe parts of a complete COA, how to read it against your specification, the warning signs of a weak or copied certificate and how to verify results.Read
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
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