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Basic Description
| Synonyms | 1-Propanaminium, 3-cyano-2-hydroxy-N,N,N-trimethyl-, chloride, (R)- | YZ14J88719 | L-Carnitinenitrile chloride |
|---|---|
| Specifications & Purity | ≥98% |
| Storage Temp | Room temperature,Desiccated |
| Shipped In | Normal |
| Product Description |
Product Application： (2R)-Carnitinenitrile Chloride is used in biological studies to stud the action of carnitine and related compounds on acetylcholine receptors of neurons from Helix aspersa. |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic nitrogen compounds
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Class
Organonitrogen compounds
- Subclass Quaternary ammonium salts
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Class
Organonitrogen compounds
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Superclass
Organic nitrogen compounds
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organic nitrogen compounds |
| Class | Organonitrogen compounds |
| Subclass | Quaternary ammonium salts |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Cholines |
| Alternative Parents | Tetraalkylammonium salts Secondary alcohols 1,2-aminoalcohols Nitriles Organopnictogen compounds Organic zwitterions Organic chloride salts Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Choline - Tetraalkylammonium salt - Secondary alcohol - 1,2-aminoalcohol - Nitrile - Carbonitrile - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organic zwitterion - Organooxygen compound - Amine - Alcohol - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation. |
| External Descriptors | Not available |
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Names and Identifiers
| Pubchem Sid | 488188604 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488188604 |
| IUPAC Name | [(2R)-3-cyano-2-hydroxypropyl]-trimethylazanium;chloride |
| INCHI | InChI=1S/C7H15N2O.ClH/c1-9(2,3)6-7(10)4-5-8;/h7,10H,4,6H2,1-3H3;1H/q+1;/p-1/t7-;/m1./s1 |
| InChIKey | ZOYKKWXSDFNANU-OGFXRTJISA-M |
| Smiles | C[N+](C)(C)CC(CC#N)O.[Cl-] |
| Isomeric SMILES | C[N+](C)(C)C[C@@H](CC#N)O.[Cl-] |
| Molecular Weight | 178.66 |
| Reaxy-Rn | 3717697 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3717697&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 F2427268 |
Certificate of Analysis | May 29, 2024 | C303316 |
| C2531017 |
Certificate of Analysis | May 29, 2024 | C303316 |
| I2223440 |
Certificate of Analysis | Aug 27, 2022 | C303316 |
| I2223441 |
Certificate of Analysis | Aug 27, 2022 | C303316 |
| I2223447 |
Certificate of Analysis | Aug 27, 2022 | C303316 |
| C23301006 |
Certificate of Analysis | Aug 27, 2022 | C303316 |
Chemical and Physical Properties
| Melt Point(°C) | 249 °C |
|---|---|
| Molecular Weight | 178.660 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 3 |
| Exact Mass | 178.087 Da |
| Monoisotopic Mass | 178.087 Da |
| Topological Polar Surface Area | 44.000 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 139.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 2 |
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