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| Canonical Smiles | CCCC[Sn](CCCC)(CCCC)C1=CC=C(C=C1)N2CCOCC2 |
|---|---|
| IUPAC Name | tributyl-(4-morpholin-4-ylphenyl)stannane |
| InChIKey | VIPDIXBRZHVCRF-UHFFFAOYSA-N |
| INCHI | 1S/C10H12NO.3C4H9.Sn/c1-2-4-10(5-3-1)11-6-8-12-9-7-11;3*1-3-4-2;/h2-5H,6-9H2;3*1,3-4H2,2H3; |
| Isomeric SMILES | CCCC[Sn](CCCC)(CCCC)C1=CC=C(C=C1)N2CCOCC2 |
| WGK Germany | 3 |
| PubChem CID | 68297642 |
| Molecular Weight | 452.26 |
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Oxazinanes |
| Subclass | Morpholines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenylmorpholines |
| Alternative Parents | Dialkylarylamines Aniline and substituted anilines Metal aryls Trialkyltins Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic salts Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Phenylmorpholine - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Monocyclic benzene moiety - Metal aryl - Benzenoid - Trialkyltin - Tertiary amine - Dialkyl ether - Ether - Oxacycle - Azacycle - Amine - Organotin compound - Organic salt - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organometallic compound - Organic post-transition metal moeity - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenylmorpholines. These are aromatic compounds containing a morpholine ring and a benzene ring linked to each other through a CC or a CN bond. |
| External Descriptors | Not available |
| Flash Point(°F) | >230 °F |
|---|---|
| Flash Point(°C) | >110 °C |
| Molecular Weight | 452.300 g/mol |
| XLogP3 | |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 11 |
| Exact Mass | 453.205 Da |
| Monoisotopic Mass | 453.205 Da |
| Topological Polar Surface Area | 12.500 Ų |
| Heavy Atom Count | 25 |
| Formal Charge | 0 |
| Complexity | 313.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| 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 | 1 |