2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE
![2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE Structure](https://image.chemsrc.com/caspic/249/5147-80-8.png)
2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE structure
|
Common Name | 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE | ||
|---|---|---|---|---|
| CAS Number | 5147-80-8 | Molecular Weight | 170.25500 | |
| Density | 1.256 g/cm3 | Boiling Point | 248.3ºC at 760 mmHg | |
| Molecular Formula | C6H6N2S2 | Melting Point | 76-78ºC | |
| MSDS | Chinese USA | Flash Point | 103.9ºC | |
| Symbol |
GHS07 |
Signal Word | Warning | |
Summary: 2-[Di(methylthio)methylidene]malononitrile, also known as 2-[Di(methylthio)methylidene]malononitrile, has a CAS number of 5147-80-8. Its molecular formula is C6H6N2S2 and molecular weight is 170.25500. This compound is an orange solid with a melting point of 76-78°C and a boiling point of 248.3°C. Its density is 1.256 g/cm3. 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-[Di(methylthio)methylidene]malononitrile |
|---|---|
| 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.
| Density | 1.256 g/cm3 |
|---|---|
| Boiling Point | 248.3ºC at 760 mmHg |
| Melting Point | 76-78ºC |
| Molecular Formula | C6H6N2S2 |
| Molecular Weight | 170.25500 |
| Flash Point | 103.9ºC |
| Exact Mass | 169.99700 |
| PSA | 98.18000 |
| LogP | 1.97116 |
| Index of Refraction | 1.584 |
| InChIKey | FICQFRCPSFCFBY-UHFFFAOYSA-N |
| SMILES | CSC(SC)=C(C#N)C#N |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H302 |
| Hazard Codes | T,Xi |
| Risk Phrases | R23/24/25 |
| Safety Phrases | S28-S36/37/39-S38-S45 |
| RIDADR | UN 3439 |
| 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 7 | |
|---|---|
| DownStream 10 | |
CAS#:75-15-0
CAS#:109-77-3
CAS#:74-88-4
CAS#:77-78-1
CAS#:4885-93-2![2-[bis(sulfanyl)methylidene]propanedinitrile Structure](https://image.chemsrc.com/caspic/364/18771-14-7.png)
CAS#:18771-14-7
CAS#:42717-51-1![2-[diethoxyphosphoryl(methylsulfanyl)methylidene]propanedinitrile structure](https://image.chemsrc.com/caspic/365/194095-91-5.png)
CAS#:194095-91-5
CAS#:72760-85-1
CAS#:15908-64-2
CAS#:116170-90-2
CAS#:129332-45-2![Propanedinitrile, [(methylthio)(phenylamino)methylene]- (en) structure](https://image.chemsrc.com/caspic/471/17823-65-3.png)
CAS#:17823-65-3
CAS#:135158-59-7![2-[(benzylamino)-methylsulfanylmethylidene]propanedinitrile structure](https://image.chemsrc.com/caspic/049/152588-23-3.png)
CAS#:152588-23-3
CAS#:15908-63-1
CAS#:175202-48-9This 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 contains target information, in‑vitro & in‑vivo assay data for this compound.
|
Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
|
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-[Bis(methylthio)methylene]malononitrile |
| 2-[bis(methylsulfanyl)methylidene]propanedinitrile |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the melting point of 2-[Di(methylthio)methylidene]malononitrile? |
| A: Melting point of 2-[Di(methylthio)methylidene]malononitrile is 76-78ºC. |
| Q: What is the English name of 2-[Di(methylthio)methylidene]malononitrile? |
| A: The English name of 2-[Di(methylthio)methylidene]malononitrile is 2-[Di(methylthio)methylidene]malononitrile. |
| Q: What are the downstream products of 2-[Di(methylthio)methylidene]malononitrile? |
| A: Related downstream products(CAS) of 2-[Di(methylthio)methylidene]malononitrile: 194095-91-5;72760-85-1;15908-64-2;116170-90-2;129332-45-2;17823-65-3;135158-59-7;152588-23-3;15908-63-1;175202-48-9. |
| Q: What is the InChIKey of 2-[Di(methylthio)methylidene]malononitrile? |
| A: InChIKey of 2-[Di(methylthio)methylidene]malononitrile is FICQFRCPSFCFBY-UHFFFAOYSA-N. |
| Q: What is the boiling point of 2-[Di(methylthio)methylidene]malononitrile? |
| A: Boiling point of 2-[Di(methylthio)methylidene]malononitrile is 248.3ºC at 760 mmHg. |
| Q: What is the safety information for 2-[Di(methylthio)methylidene]malononitrile? |
| A: Safety information for 2-[Di(methylthio)methylidene]malononitrile: S28-S36/37/39-S38-S45. |
| Q: What are the upstream materials of 2-[Di(methylthio)methylidene]malononitrile? |
| A: Related upstream materials(CAS) of 2-[Di(methylthio)methylidene]malononitrile: 75-15-0;109-77-3;74-88-4;77-78-1;4885-93-2;18771-14-7;42717-51-1. |
| Q: What is the SMILES notation of 2-[Di(methylthio)methylidene]malononitrile? |
| A: SMILES notation of 2-[Di(methylthio)methylidene]malononitrile is CSC(SC)=C(C#N)C#N. |
| Q: What is the CAS number of 2-[Di(methylthio)methylidene]malononitrile? |
| A: CAS number of 2-[Di(methylthio)methylidene]malononitrile is 5147-80-8. |
| Q: What is the polar surface area (PSA) of 2-[Di(methylthio)methylidene]malononitrile? |
| A: Polar surface area (PSA) of 2-[Di(methylthio)methylidene]malononitrile is 98.18000. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |