6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one
6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one structure
|
Common Name | 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one | ||
|---|---|---|---|---|
| CAS Number | 67218-06-8 | Molecular Weight | 226.37800 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C13H22OS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one |
|---|
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C13H22OS |
|---|---|
| Molecular Weight | 226.37800 |
| Exact Mass | 226.13900 |
| PSA | 42.37000 |
| LogP | 4.18280 |
| InChIKey | RPZACQAWPXKHSO-UHFFFAOYSA-N |
| SMILES | CCCCSC=C1CCCC(C)(C)C1=O |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~%
6-(butylsulfany... CAS#:67218-06-8 |
| Literature: Ireland; Marshall Journal of the American Chemical Society, 1959 , vol. 81, p. 6336 Journal of Organic Chemistry, 1962 , vol. 27, p. 1615,1618 |
|
~%
6-(butylsulfany... CAS#:67218-06-8 |
| Literature: Groot, Aede de; Jansen, Ben J. M. Journal of Organic Chemistry, 1984 , vol. 49, # 11 p. 2034 - 2035 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 3 | |
CAS#:81053-99-8
CAS#:89656-06-4
CAS#:89656-08-6This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What are the upstream materials of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: Related upstream materials(CAS) of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one: 32116-70-4;74-88-4;109-79-5;1193-47-1;109-94-4. |
| Q: What is the InChIKey of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: InChIKey of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is RPZACQAWPXKHSO-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: SMILES notation of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is CCCCSC=C1CCCC(C)(C)C1=O. |
| Q: What is the polar surface area (PSA) of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: Polar surface area (PSA) of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is 42.37000. |
| Q: What are the downstream products of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: Related downstream products(CAS) of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one: 81053-99-8;89656-06-4;89656-08-6. |
| Q: What is the English name of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: The English name of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one. |
| Q: What is the LogP of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: LogP of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is 4.18280. |
| Q: What is the CAS number of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: CAS number of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is 67218-06-8. |
| Q: What is the molecular formula of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: Molecular formula of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is C13H22OS. |
| Q: What is the molecular weight of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one? |
| A: Molecular weight of 6-(butylsulfanylmethylidene)-2,2-dimethylcyclohexan-1-one is 226.37800. |