2-phenylethyl thiocyanate
2-phenylethyl thiocyanate structure
|
Common Name | 2-phenylethyl thiocyanate | ||
|---|---|---|---|---|
| CAS Number | 5654-72-8 | Molecular Weight | 163.23900 | |
| Density | N/A | Boiling Point | N/A | |
| Molecular Formula | C9H9NS | Melting Point | N/A | |
| MSDS | N/A | Flash Point | N/A | |
Summary: 2-phenylethyl thiocyanate, Chinese name 2-苯乙基硫氰酸盐, CAS number 5654-72-8, molecular formula C9H9NS, molecular weight 163.23900, 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 | 2-phenylethyl thiocyanate |
|---|---|
| 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 | C9H9NS |
|---|---|
| Molecular Weight | 163.23900 |
| Exact Mass | 163.04600 |
| PSA | 49.09000 |
| LogP | 2.44338 |
| InChIKey | HUKWNFVGBRDJIM-UHFFFAOYSA-N |
| SMILES | N#CSCCc1ccccc1 |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| HS Code | 2930909090 |
|---|
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 9 | |
|---|---|
| DownStream 1 | |
CAS#:333-20-0
CAS#:103-63-9
CAS#:60-12-8
CAS#:622-24-2![[2-(Trimethylsiloxy)ethyl]benzene Structure](https://image.chemsrc.com/caspic/393/14629-58-4.png)
CAS#:14629-58-4
CAS#:3674-54-2
CAS#:1927-61-3
CAS#:4410-99-5
CAS#:859214-49-6
CAS#:4025-71-2This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2930909090 |
|---|---|
| Summary | 2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Thiocyanic acid,2-phenylethyl ester |
| Phenaethylthiocyanat |
| phenethyl thiocyanate |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the polar surface area (PSA) of 2-phenylethyl thiocyanate? |
| A: Polar surface area (PSA) of 2-phenylethyl thiocyanate is 49.09000. |
| Q: What is the molecular weight of 2-phenylethyl thiocyanate? |
| A: Molecular weight of 2-phenylethyl thiocyanate is 163.23900. |
| Q: What is the English name of 2-phenylethyl thiocyanate? |
| A: The English name of 2-phenylethyl thiocyanate is 2-phenylethyl thiocyanate. |
| Q: What is the LogP of 2-phenylethyl thiocyanate? |
| A: LogP of 2-phenylethyl thiocyanate is 2.44338. |
| Q: What are the downstream products of 2-phenylethyl thiocyanate? |
| A: Related downstream products(CAS) of 2-phenylethyl thiocyanate: 4025-71-2. |
| Q: What is the molecular formula of 2-phenylethyl thiocyanate? |
| A: Molecular formula of 2-phenylethyl thiocyanate is C9H9NS. |
| Q: What is the InChIKey of 2-phenylethyl thiocyanate? |
| A: InChIKey of 2-phenylethyl thiocyanate is HUKWNFVGBRDJIM-UHFFFAOYSA-N. |
| Q: What is the SMILES notation of 2-phenylethyl thiocyanate? |
| A: SMILES notation of 2-phenylethyl thiocyanate is N#CSCCc1ccccc1. |
| Q: What is the Chinese name of 5654-72-8? |
| A: Chinese name of 5654-72-8 is 5654-72-8. |
| Q: What is the CAS number of 2-phenylethyl thiocyanate? |
| A: CAS number of 2-phenylethyl thiocyanate is 5654-72-8. |