hept-1-ynylsulfanylbenzene
hept-1-ynylsulfanylbenzene structure
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Common Name | hept-1-ynylsulfanylbenzene | ||
|---|---|---|---|---|
| CAS Number | 91075-96-6 | Molecular Weight | 204.33100 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C13H16S | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: Hept-1-ynylsulfanylbenzene (Nonynylsulfenylbenzene), CAS number 91075-96-6, molecular formula C13H16S, molecular weight 204.33100. For research-use only, not for medical or clinical usage.
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | hept-1-ynylsulfanylbenzene |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Molecular Formula | C13H16S |
|---|---|
| Molecular Weight | 204.33100 |
| Exact Mass | 204.09700 |
| PSA | 25.30000 |
| LogP | 4.31990 |
| InChIKey | NBOLBHBLFHIOQP-UHFFFAOYSA-N |
| SMILES | CCCCCC#CSc1ccccc1 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~93%
hept-1-ynylsulf... CAS#:91075-96-6 |
| Literature: Yang, Yong; Dong, Weibing; Guo, Yisong; Rioux, Robert M. Green Chemistry, 2013 , vol. 15, # 11 p. 3170 - 3175 |
|
~44%
hept-1-ynylsulf... CAS#:91075-96-6
Learn More
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| Literature: Braga, Antonio L.; Comasseto, Joao V.; Petragnani, Nicola Tetrahedron Letters, 1984 , vol. 25, # 11 p. 1111 - 1114 |
|
~44%
hept-1-ynylsulf... CAS#:91075-96-6 |
| Literature: Braga; Silveira; Reckziegel; Menezes Tetrahedron Letters, 1993 , vol. 34, # 50 p. 8041 - 8042 |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| hept-1-ynylsulfanyl-benzene |
| 1-phenylthio-1-heptyne |
| Benzene,(1-heptynylthio) |
| (1-heptynylsulfanyl)benzene |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of hept-1-ynylsulfanylbenzene? |
| A: InChIKey of hept-1-ynylsulfanylbenzene is NBOLBHBLFHIOQP-UHFFFAOYSA-N. |
| Q: What is the CAS number of hept-1-ynylsulfanylbenzene? |
| A: CAS number of hept-1-ynylsulfanylbenzene is 91075-96-6. |
| Q: What is the Chinese name of 91075-96-6? |
| A: Chinese name of 91075-96-6 is 91075-96-6. |
| Q: What is the molecular formula of hept-1-ynylsulfanylbenzene? |
| A: Molecular formula of hept-1-ynylsulfanylbenzene is C13H16S. |
| Q: What is the LogP of hept-1-ynylsulfanylbenzene? |
| A: LogP of hept-1-ynylsulfanylbenzene is 4.31990. |
| Q: What is the molecular weight of hept-1-ynylsulfanylbenzene? |
| A: Molecular weight of hept-1-ynylsulfanylbenzene is 204.33100. |
| Q: What is the SMILES notation of hept-1-ynylsulfanylbenzene? |
| A: SMILES notation of hept-1-ynylsulfanylbenzene is CCCCCC#CSc1ccccc1. |
| Q: What is the polar surface area (PSA) of hept-1-ynylsulfanylbenzene? |
| A: Polar surface area (PSA) of hept-1-ynylsulfanylbenzene is 25.30000. |
| Q: What English synonyms does hept-1-ynylsulfanylbenzene have? |
| A: English synonyms of hept-1-ynylsulfanylbenzene: hept-1-ynylsulfanyl-benzene, 1-phenylthio-1-heptyne, Benzene,(1-heptynylthio), (1-heptynylsulfanyl)benzene. |
| Q: What is the English name of hept-1-ynylsulfanylbenzene? |
| A: The English name of hept-1-ynylsulfanylbenzene is hept-1-ynylsulfanylbenzene. |