5-heptyl-2-hydroxybenzonitrile
5-heptyl-2-hydroxybenzonitrile structure
|
Common Name | 5-heptyl-2-hydroxybenzonitrile | ||
|---|---|---|---|---|
| CAS Number | 52899-66-8 | Molecular Weight | 217.30700 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C14H19NO | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 5-Heptyl-2-hydroxybenzonitrile, Chinese name 5-庚基-2-羟基苯氰, CAS number 52899-66-8, molecular formula C14H19NO, molecular weight 217.30700. 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 | 5-heptyl-2-hydroxybenzonitrile |
|---|---|
| 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 | C14H19NO |
|---|---|
| Molecular Weight | 217.30700 |
| Exact Mass | 217.14700 |
| PSA | 44.02000 |
| LogP | 3.77678 |
| InChIKey | LNRNXTQHDQVBPJ-UHFFFAOYSA-N |
| SMILES | CCCCCCCC1=CC(=C(C=C1)O)C#N |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
|
~45%
5-heptyl-2-hydr... CAS#:52899-66-8 |
| Literature: Hong, X. J.; Ge, M. J.; Zhao, X. M.; Fen, Z. R.; Liu, Z. J. Molecular Crystals and Liquid Crystals (1969-1991), 1983 , vol. 99, p. 81 - 88 |
|
~%
5-heptyl-2-hydr... CAS#:52899-66-8 |
| Literature: Hong, X. J.; Ge, M. J.; Zhao, X. M.; Fen, Z. R.; Liu, Z. J. Molecular Crystals and Liquid Crystals (1969-1991), 1983 , vol. 99, p. 81 - 88 |
|
~%
5-heptyl-2-hydr... CAS#:52899-66-8 |
| Literature: Hong, X. J.; Ge, M. J.; Zhao, X. M.; Fen, Z. R.; Liu, Z. J. Molecular Crystals and Liquid Crystals (1969-1991), 1983 , vol. 99, p. 81 - 88 |
|
~%
5-heptyl-2-hydr... CAS#:52899-66-8 |
| Literature: Hong, X. J.; Ge, M. J.; Zhao, X. M.; Fen, Z. R.; Liu, Z. J. Molecular Crystals and Liquid Crystals (1969-1991), 1983 , vol. 99, p. 81 - 88 |
|
~%
5-heptyl-2-hydr... CAS#:52899-66-8
Learn More
|
| Literature: Hong, X. J.; Ge, M. J.; Zhao, X. M.; Fen, Z. R.; Liu, Z. J. Molecular Crystals and Liquid Crystals (1969-1991), 1983 , vol. 99, p. 81 - 88 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 5 | |
|---|---|
| DownStream 2 | |
![2-cyano-4-heptylphenyl 4'-pentyl[1,1'-biphenyl]-4-carboxylate structure](https://image.chemsrc.com/caspic/184/65195-04-2.png)
CAS#:65195-04-2
CAS#:62390-67-4This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-cyano 4-n-heptylphenol |
| Benzonitrile,5-heptyl-2-hydroxy |
| 2-hydroxy-5-heptyl benzonitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the InChIKey of 5-heptyl-2-hydroxybenzonitrile? |
| A: InChIKey of 5-heptyl-2-hydroxybenzonitrile is LNRNXTQHDQVBPJ-UHFFFAOYSA-N. |
| Q: What is the Chinese name of 52899-66-8? |
| A: Chinese name of 52899-66-8 is 52899-66-8. |
| Q: What is the LogP of 5-heptyl-2-hydroxybenzonitrile? |
| A: LogP of 5-heptyl-2-hydroxybenzonitrile is 3.77678. |
| Q: What are the downstream products of 5-heptyl-2-hydroxybenzonitrile? |
| A: Related downstream products(CAS) of 5-heptyl-2-hydroxybenzonitrile: 65195-04-2;62390-67-4. |
| Q: What English synonyms does 5-heptyl-2-hydroxybenzonitrile have? |
| A: English synonyms of 5-heptyl-2-hydroxybenzonitrile: 2-cyano 4-n-heptylphenol, Benzonitrile,5-heptyl-2-hydroxy, 2-hydroxy-5-heptyl benzonitrile. |
| Q: What is the molecular weight of 5-heptyl-2-hydroxybenzonitrile? |
| A: Molecular weight of 5-heptyl-2-hydroxybenzonitrile is 217.30700. |
| Q: What is the polar surface area (PSA) of 5-heptyl-2-hydroxybenzonitrile? |
| A: Polar surface area (PSA) of 5-heptyl-2-hydroxybenzonitrile is 44.02000. |
| Q: What is the molecular formula of 5-heptyl-2-hydroxybenzonitrile? |
| A: Molecular formula of 5-heptyl-2-hydroxybenzonitrile is C14H19NO. |
| Q: What is the SMILES notation of 5-heptyl-2-hydroxybenzonitrile? |
| A: SMILES notation of 5-heptyl-2-hydroxybenzonitrile is CCCCCCCC1=CC(=C(C=C1)O)C#N. |
| Q: What are the upstream materials of 5-heptyl-2-hydroxybenzonitrile? |
| A: Related upstream materials(CAS) of 5-heptyl-2-hydroxybenzonitrile: 88134-03-6;1987-50-4;88134-01-4;88134-02-5;544-92-3. |