Alinidine
Also known as Alinidina, Alinidinum, St 567 br (as hbr)
Key facts
What buyers check first
- CAS number
- 33178-86-8
- Formula
- C12H13Cl2N3
- Molar mass
- 270.16 g/mol
- EC number
- 636-481-4
- HS code
- 293329
- Category
- Heterocyclic building blocks
What is Alinidine?
Plain description, key identifiers and synonyms
Alinidine is a chemical substance with the molecular formula C12H13Cl2N3 and a molar mass of 270.16 g/mol. Its CAS registry number is 33178-86-8. The IUPAC name is N-(2,6-dichlorophenyl)-N-prop-2-enyl-4,5-dihydro-1H-imidazol-2-amine.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- N-(2,6-dichlorophenyl)-N-prop-2-enyl-4,5-dihydro-1H-imidazol-2-amine
- CAS number
- 33178-86-8 CAS number cross-checked
- EC number
- 636-481-4
- Molecular formula
- C12H13Cl2N3
- UNII
- E7IDJ8DS1D
- InChIKey
- OXTYVEUAQHPPMV-UHFFFAOYSA-N
- InChI
- InChI=1S/C12H13Cl2N3/c1-2-8-17(12-15-6-7-16-12)11-9(13)4-3-5-10(11)14/h2-5H,1,6-8H2,(H,15,16)
- SMILES (canonical and isomeric)
- C=CCN(C1=C(C=CC=C1Cl)Cl)C2=NCCN2
Synonyms
- Alinidina
- Alinidinum
- St 567 br (as hbr)
- St 567-br (as hbr)
- St-567-br-(as-hbr)
- 2-(N-Allyl-N-(2,6-dichlorophenyl)amino)-2-imidazoline
- St 567 br (as hydrobromide)
- St 567-br (as hydrobromide)
- st-567-br-(as-Hydrobromide)
- N-allylclonidine
- ST 567-BR
- 2-(N-Allyl-2,6-dichloroanilino)-2-imidazoline
- N-Allyl-N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine
- 1H-Imidazol-2-amine, N-(2,6-dichlorophenyl)-4,5-dihydro-N-2-propenyl-
- N-(2,6-dichlorophenyl)-N-prop-2-enyl-4,5-dihydro-1H-imidazol-2-amine
- Alinidin
- 2-Imidazoline, 2-(N-allyl-2,6-dichloroanilino)-
- Allindine
- 5-25-09-00280 (Beilstein Handbook Reference)
- N-(2,6-dichlorophenyl)-N-(prop-2-en-1-yl)-4,5-dihydro-1H-imidazol-2-amine
- Sdccgsbi-0633723.p001
- 2-[N-allyl-N-(2,6-dichloro-phenyl)-amino]-2-imidazoline
- N-Allyl-N-(2,6-dichlorophenyl)-4,5-dihydro-1H-imidazol-2-amine #
- N-(2,6-dichlorophenyl)-N-prop-2-en-1-yl-4,5-dihydro-1H-imidazol-2-amine
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 | 270.16 g/molcalc.Computed value |
|---|---|
| Exact mass | 269.0487 Dacalc.Computed value |
| LogP (octanol/water) | 2.95calc.Computed value |
| Topological polar surface area | 27.63 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 1calc.Computed value |
| Hydrogen bond acceptors | 3calc.Computed value |
| Rotatable bonds | 3calc.Computed value |
| Heavy atoms | 17calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 1calc.Computed value |
| Fraction sp3 carbons | 0.25calc.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
c1ccc(NC2=NCCN2)cc1
2 rings, 12 atoms, the Imidazolidine, 2-(phenylimino)- ring system.
276 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H301Toxic if swallowed.
- H315Causes skin irritation.
- H319Causes serious eye irritation.
- H335May cause respiratory irritation.
Precautionary statements (19)
- 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.
- P280Wear protective gloves, protective clothing, eye protection and face 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 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P319Get medical help if you feel unwell.
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P332 + P317If skin irritation occurs: Get medical help.
- P337 + P317If eye irritation persists: Get medical help.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- 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.
Full safety data and first aidAlinidine suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- United States, ElginUnclaimed profileAlinidineGrade, purity and minimum order on requestPrice on request
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Where suppliers are based
1 supplier in 1 country
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Alinidine 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
Pharmacological actions
- Anti-Arrhythmia Agents
- Cardiovascular Agents
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 Alinidine is traded under.
Compounds containing an unfused imidazole ring (whether or not hydrogenated) in theโฆ
- United Kingdom13.0%
- United States7.9%
- China6.5%
* Partner reported figures, a lower bound.
The HS code shown for Alinidine is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Alinidine, based on the data on this page
What is Alinidine?
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What is the molecular formula and weight of Alinidine?
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Is Alinidine hazardous?
What is the HS code of Alinidine?
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Guides for buyers
Practical guides that help when you source, ship or handle Alinidine
- 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
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
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